T16
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR1 | C1 | sing | 1.97Å | 1.80Å | |
| BR2 | C1 | sing | 1.97Å | 1.71Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22A | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | H31 | sing | 1.09Å | 1.12Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | B | sing | 1.57Å | 1.58Å | |
| C4 | N5 | sing | 1.47Å | 1.49Å | |
| C4 | H4 | sing | 1.09Å | 1.11Å | |
| B | O1A | sing | 1.42Å | 1.36Å | |
| B | O1B | sing | 1.42Å | 1.38Å | |
| O1A | HO1A | sing | 0.97Å | 0.95Å | |
| O1B | HO1B | sing | 0.97Å | 0.95Å | |
| N5 | C6 | sing | 1.35Å | 1.49Å | |
| N5 | HN5 | sing | 0.97Å | 1.02Å | |
| O6 | C6 | doub | 1.21Å | 1.22Å | |
| C6 | C7 | sing | 1.51Å | 1.51Å | |
| C7 | C7A | sing | 1.55Å | 1.57Å | |
| C7 | N8 | sing | 1.47Å | 1.50Å | |
| C7 | H7 | sing | 1.09Å | 1.11Å | |
| C7A | C7B | sing | 1.55Å | 1.57Å | |
| C7A | H7A1 | sing | 1.09Å | 1.12Å | |
| C7A | H7A2 | sing | 1.09Å | 1.12Å | |
| C7B | C7C | sing | 1.54Å | 1.55Å | |
| C7B | H7B1 | sing | 1.09Å | 1.11Å | |
| C7B | H7B2 | sing | 1.09Å | 1.11Å | |
| C7C | N8 | sing | 1.47Å | 1.51Å | |
| C7C | H7C1 | sing | 1.09Å | 1.12Å | |
| C7C | H7C2 | sing | 1.09Å | 1.11Å | |
| N8 | C9 | sing | 1.35Å | 1.45Å | |
| O9 | C9 | doub | 1.21Å | 1.27Å | |
| C9 | C10 | sing | 1.51Å | 1.53Å | |
| C10 | N12 | sing | 1.46Å | 1.42Å | |
| C10 | C11 | sing | 1.53Å | 1.49Å | |
| C10 | H10 | sing | 1.09Å | 1.12Å | |
| N12 | C13 | sing | 1.35Å | 1.43Å | |
| N12 | HN2 | sing | 0.97Å | 1.02Å | |
| C11 | C21 | sing | 1.51Å | 1.51Å | |
| C11 | H111 | sing | 1.09Å | 1.11Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C21 | C22 | doub | 1.38Å | 1.42Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å | |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.38Å | 1.43Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.10Å | |
| C25 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.10Å | |
| O13 | C13 | doub | 1.21Å | 1.23Å | |
| C13 | C14 | sing | 1.51Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | H141 | sing | 1.09Å | 1.11Å | |
| C14 | H142 | sing | 1.09Å | 1.12Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C15 | H151 | sing | 1.09Å | 1.11Å | |
| C15 | H152 | sing | 1.09Å | 1.12Å | |
| C16 | C17 | sing | 1.51Å | 1.54Å | |
| C16 | H161 | sing | 1.09Å | 1.12Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | O17 | doub | 1.21Å | 1.25Å | |
| C17 | H17 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR1 | C1 | BR2 | 90.8° | 109.4° |
| BR1 | C1 | C2 | 102.5° | 109.5° |
| BR1 | C1 | H1 | 120.3° | 109.5° |
| BR2 | C1 | C2 | 96.1° | 109.4° |
| BR2 | C1 | H1 | 125.2° | 109.5° |
| C2 | C1 | H1 | 116.4° | 109.5° |
| C1 | C2 | C3 | 105.9° | 109.5° |
| C1 | C2 | H21 | 113.5° | 109.4° |
| C1 | C2 | H22A | 113.5° | 109.6° |
| C3 | C2 | H21 | 113.5° | 109.4° |
| C3 | C2 | H22A | 113.5° | 109.5° |
| C2 | C3 | C4 | 119.6° | 109.5° |
| C2 | C3 | H31 | 108.6° | 109.5° |
| C2 | C3 | H32 | 108.6° | 109.5° |
| H21 | C2 | H22A | 97.0° | 109.4° |
| C4 | C3 | H31 | 108.6° | 109.5° |
| C4 | C3 | H32 | 108.6° | 109.5° |
| C3 | C4 | B | 110.0° | 109.5° |
| C3 | C4 | N5 | 112.1° | 109.5° |
| C3 | C4 | H4 | 107.1° | 109.5° |
| H31 | C3 | H32 | 101.4° | 109.5° |
| B | C4 | N5 | 109.1° | 109.4° |
| B | C4 | H4 | 110.3° | 109.6° |
| C4 | B | O1A | 116.5° | 120.1° |
| C4 | B | O1B | 115.0° | 120.0° |
| N5 | C4 | H4 | 108.2° | 109.4° |
| C4 | N5 | C6 | 115.7° | 120.0° |
| C4 | N5 | HN5 | 122.2° | 120.0° |
| O1A | B | O1B | 111.8° | 119.9° |
| B | O1A | HO1A | 116.4° | 106.9° |
| B | O1B | HO1B | 115.0° | 106.8° |
| C6 | N5 | HN5 | 122.2° | 120.0° |
| N5 | C6 | O6 | 121.0° | 120.0° |
| N5 | C6 | C7 | 118.2° | 120.0° |
| O6 | C6 | C7 | 119.7° | 120.0° |
| C6 | C7 | C7A | 112.4° | 110.4° |
| C6 | C7 | N8 | 105.9° | 110.3° |
| C6 | C7 | H7 | 107.9° | 110.3° |
| C7A | C7 | N8 | 102.7° | 105.0° |
| C7A | C7 | H7 | 110.9° | 110.4° |
| C7 | C7A | C7B | 106.0° | 101.5° |
| C7 | C7A | H7A1 | 113.5° | 111.0° |
| C7 | C7A | H7A2 | 113.5° | 111.0° |
| N8 | C7 | H7 | 116.9° | 110.4° |
| C7 | N8 | C7C | 118.1° | 108.6° |
| C7 | N8 | C9 | 116.9° | 125.7° |
| C7B | C7A | H7A1 | 113.5° | 111.0° |
| C7B | C7A | H7A2 | 113.5° | 111.0° |
| C7A | C7B | C7C | 111.0° | 102.9° |
| C7A | C7B | H7B1 | 111.6° | 110.7° |
| C7A | C7B | H7B2 | 111.6° | 110.7° |
| H7A1 | C7A | H7A2 | 96.9° | 110.9° |
| C7C | C7B | H7B1 | 111.6° | 110.8° |
| C7C | C7B | H7B2 | 111.7° | 110.8° |
| C7B | C7C | N8 | 100.1° | 107.3° |
| C7B | C7C | H7C1 | 115.8° | 109.9° |
| C7B | C7C | H7C2 | 115.8° | 109.9° |
| H7B1 | C7B | H7B2 | 98.8° | 110.7° |
| N8 | C7C | H7C1 | 115.8° | 109.9° |
| N8 | C7C | H7C2 | 115.8° | 109.8° |
| C7C | N8 | C9 | 124.7° | 125.7° |
| H7C1 | C7C | H7C2 | 94.6° | 110.0° |
| N8 | C9 | O9 | 115.4° | 120.1° |
| N8 | C9 | C10 | 137.7° | 119.9° |
| O9 | C9 | C10 | 105.3° | 120.0° |
| C9 | C10 | N12 | 102.9° | 109.5° |
| C9 | C10 | C11 | 124.6° | 109.5° |
| C9 | C10 | H10 | 108.4° | 109.5° |
| N12 | C10 | C11 | 119.4° | 109.4° |
| N12 | C10 | H10 | 115.7° | 109.4° |
| C10 | N12 | C13 | 154.4° | 120.0° |
| C10 | N12 | HN2 | 101.8° | 119.9° |
| C11 | C10 | H10 | 84.9° | 109.5° |
| C10 | C11 | C21 | 119.6° | 109.5° |
| C10 | C11 | H111 | 108.5° | 109.5° |
| C10 | C11 | H112 | 108.5° | 109.5° |
| C13 | N12 | HN2 | 103.8° | 120.1° |
| N12 | C13 | O13 | 114.6° | 120.0° |
| N12 | C13 | C14 | 122.9° | 120.0° |
| C21 | C11 | H111 | 108.6° | 109.4° |
| C21 | C11 | H112 | 108.6° | 109.5° |
| C11 | C21 | C22 | 117.2° | 120.0° |
| C11 | C21 | C26 | 122.1° | 120.0° |
| H111 | C11 | H112 | 101.5° | 109.5° |
| C22 | C21 | C26 | 120.3° | 120.0° |
| C21 | C22 | C23 | 119.4° | 120.0° |
| C21 | C22 | H22 | 120.6° | 120.0° |
| C21 | C26 | C25 | 120.1° | 120.0° |
| C21 | C26 | H26 | 119.7° | 120.0° |
| C23 | C22 | H22 | 120.0° | 120.0° |
| C22 | C23 | C24 | 120.5° | 120.0° |
| C22 | C23 | H23 | 120.4° | 120.0° |
| C24 | C23 | H23 | 119.1° | 120.0° |
| C23 | C24 | C25 | 120.1° | 120.0° |
| C23 | C24 | H24 | 118.7° | 120.0° |
| C25 | C24 | H24 | 121.2° | 120.0° |
| C24 | C25 | C26 | 119.6° | 120.0° |
| C24 | C25 | H25 | 121.0° | 120.0° |
| C26 | C25 | H25 | 119.4° | 120.0° |
| C25 | C26 | H26 | 120.1° | 120.0° |
| O13 | C13 | C14 | 121.3° | 120.0° |
| C13 | C14 | C15 | 117.9° | 109.5° |
| C13 | C14 | H141 | 109.2° | 109.5° |
| C13 | C14 | H142 | 109.2° | 109.5° |
| C15 | C14 | H141 | 109.2° | 109.4° |
| C15 | C14 | H142 | 109.2° | 109.5° |
| C14 | C15 | C16 | 118.4° | 109.5° |
| C14 | C15 | H151 | 109.0° | 109.5° |
| C14 | C15 | H152 | 109.0° | 109.5° |
| H141 | C14 | H142 | 100.9° | 109.5° |
| C16 | C15 | H151 | 109.0° | 109.5° |
| C16 | C15 | H152 | 108.9° | 109.5° |
| C15 | C16 | C17 | 113.4° | 109.5° |
| C15 | C16 | H161 | 110.8° | 109.5° |
| C15 | C16 | H162 | 110.8° | 109.5° |
| H151 | C15 | H152 | 101.1° | 109.4° |
| C17 | C16 | H161 | 110.8° | 109.4° |
| C17 | C16 | H162 | 110.8° | 109.4° |
| C16 | C17 | O17 | 115.8° | 120.1° |
| C16 | C17 | H17 | 131.5° | 120.0° |
| H161 | C16 | H162 | 99.6° | 109.4° |
| O17 | C17 | H17 | 112.6° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR1 | C1 | BR2 | C2 | 102.7° | 120.0° |
| BR1 | C1 | BR2 | H1 | 128.9° | 120.0° |
| BR1 | C1 | C2 | H1 | 133.4° | 120.1° |
| BR1 | C1 | C2 | C3 | 98.5° | 180.0° |
| BR1 | C1 | C2 | H21 | 26.7° | 60.1° |
| BR1 | C1 | C2 | H22A | 136.2° | 59.9° |
| BR2 | C1 | C2 | H1 | 134.4° | 120.0° |
| BR2 | C1 | C2 | C3 | 169.2° | 60.1° |
| BR2 | C1 | C2 | H21 | 65.6° | 180.0° |
| BR2 | C1 | C2 | H22A | 44.0° | 60.0° |
| C1 | C2 | C3 | H21 | 125.2° | 119.9° |
| C1 | C2 | C3 | H22A | 125.3° | 120.1° |
| C1 | C2 | H21 | H22A | 119.5° | 120.0° |
| C1 | C2 | C3 | C4 | 172.6° | 179.9° |
| C1 | C2 | C3 | H31 | 47.3° | 60.1° |
| C1 | C2 | C3 | H32 | 62.1° | 60.0° |
| H1 | C1 | C2 | C3 | 34.8° | 59.9° |
| H1 | C1 | C2 | H21 | 160.0° | 60.0° |
| H1 | C1 | C2 | H22A | 90.4° | 180.0° |
| C3 | C2 | H21 | H22A | 119.4° | 120.0° |
| C2 | C3 | C4 | H31 | 125.3° | 120.0° |
| C2 | C3 | C4 | H32 | 125.3° | 120.0° |
| C2 | C3 | H31 | H32 | 114.2° | 120.0° |
| C2 | C3 | C4 | B | 173.0° | 60.0° |
| C2 | C3 | C4 | N5 | 65.4° | 180.0° |
| C2 | C3 | C4 | H4 | 53.1° | 60.1° |
| H21 | C2 | C3 | C4 | 62.2° | 60.0° |
| H21 | C2 | C3 | H31 | 172.6° | 180.0° |
| H21 | C2 | C3 | H32 | 63.1° | 60.0° |
| H22A | C2 | C3 | C4 | 47.3° | 59.9° |
| H22A | C2 | C3 | H31 | 77.9° | 60.0° |
| H22A | C2 | C3 | H32 | 172.6° | 179.9° |
| C4 | C3 | H31 | H32 | 114.2° | 120.0° |
| C3 | C4 | B | N5 | 123.4° | 120.0° |
| C3 | C4 | B | H4 | 118.0° | 120.0° |
| C3 | C4 | N5 | H4 | 117.9° | 119.9° |
| C3 | C4 | B | O1A | 172.9° | 60.0° |
| C3 | C4 | B | O1B | 53.6° | 120.0° |
| C3 | C4 | N5 | C6 | 120.7° | 150.0° |
| C3 | C4 | N5 | HN5 | 59.4° | 30.0° |
| H31 | C3 | C4 | B | 47.7° | 180.0° |
| H31 | C3 | C4 | N5 | 169.3° | 60.0° |
| H31 | C3 | C4 | H4 | 72.2° | 59.9° |
| H32 | C3 | C4 | B | 61.7° | 59.9° |
| H32 | C3 | C4 | N5 | 59.9° | 60.0° |
| H32 | C3 | C4 | H4 | 178.4° | 180.0° |
| B | C4 | N5 | H4 | 120.0° | 120.1° |
| C4 | B | O1A | O1B | 134.9° | 180.0° |
| C4 | B | O1A | HO1A | 180.0° | 180.0° |
| C4 | B | O1B | HO1B | 180.0° | 180.0° |
| B | C4 | N5 | C6 | 117.2° | 90.0° |
| B | C4 | N5 | HN5 | 62.7° | 90.0° |
| N5 | C4 | B | O1A | 49.5° | 60.0° |
| N5 | C4 | B | O1B | 176.9° | 120.0° |
| C4 | N5 | C6 | HN5 | 180.0° | 180.0° |
| C4 | N5 | C6 | O6 | 7.0° | 0.0° |
| C4 | N5 | C6 | C7 | 174.9° | 180.0° |
| H4 | C4 | B | O1A | 69.1° | 180.0° |
| H4 | C4 | B | O1B | 64.4° | 0.0° |
| H4 | C4 | N5 | C6 | 2.8° | 30.0° |
| H4 | C4 | N5 | HN5 | 177.3° | 149.9° |
| O1A | B | O1B | HO1B | 44.4° | 0.0° |
| O1B | B | O1A | HO1A | 45.0° | 0.0° |
| N5 | C6 | O6 | C7 | 167.7° | 180.0° |
| N5 | C6 | C7 | C7A | 96.4° | 89.7° |
| N5 | C6 | C7 | N8 | 152.2° | 154.7° |
| N5 | C6 | C7 | H7 | 26.2° | 32.5° |
| HN5 | N5 | C6 | O6 | 172.9° | 179.9° |
| HN5 | N5 | C6 | C7 | 5.1° | 0.0° |
| O6 | C6 | C7 | C7A | 71.7° | 90.3° |
| O6 | C6 | C7 | N8 | 39.8° | 25.2° |
| O6 | C6 | C7 | H7 | 165.7° | 147.5° |
| C6 | C7 | C7A | N8 | 113.4° | 118.9° |
| C6 | C7 | C7A | H7 | 120.9° | 122.2° |
| C6 | C7 | N8 | H7 | 120.3° | 122.2° |
| C6 | C7 | C7A | C7B | 119.0° | 155.8° |
| C6 | C7 | C7A | H7A1 | 6.3° | 37.8° |
| C6 | C7 | C7A | H7A2 | 115.7° | 86.1° |
| C6 | C7 | N8 | C7C | 114.3° | 142.9° |
| C6 | C7 | N8 | C9 | 71.5° | 37.1° |
| C7A | C7 | N8 | H7 | 121.6° | 118.9° |
| C7 | C7A | C7B | H7A1 | 125.3° | 118.0° |
| C7 | C7A | C7B | H7A2 | 125.3° | 118.1° |
| C7 | C7A | H7A1 | H7A2 | 119.4° | 123.9° |
| C7 | C7A | C7B | C7C | 13.1° | 35.5° |
| C7 | C7A | C7B | H7B1 | 138.4° | 153.9° |
| C7 | C7A | C7B | H7B2 | 112.1° | 82.9° |
| C7A | C7 | N8 | C7C | 3.8° | 24.0° |
| C7A | C7 | N8 | C9 | 170.4° | 156.0° |
| N8 | C7 | C7A | C7B | 5.6° | 37.0° |
| N8 | C7 | C7A | H7A1 | 119.7° | 81.1° |
| N8 | C7 | C7A | H7A2 | 130.9° | 155.0° |
| C7 | N8 | C7C | C7B | 11.3° | 1.0° |
| C7 | N8 | C7C | C9 | 173.8° | 180.0° |
| C7 | N8 | C7C | H7C1 | 113.9° | 120.4° |
| C7 | N8 | C7C | H7C2 | 136.6° | 118.5° |
| C7 | N8 | C9 | O9 | 22.0° | 5.5° |
| C7 | N8 | C9 | C10 | 175.0° | 174.5° |
| H7 | C7 | C7A | C7B | 120.1° | 82.0° |
| H7 | C7 | C7A | H7A1 | 114.6° | 160.0° |
| H7 | C7 | C7A | H7A2 | 5.2° | 36.1° |
| H7 | C7 | N8 | C7C | 125.5° | 94.9° |
| H7 | C7 | N8 | C9 | 48.8° | 85.1° |
| C7B | C7A | H7A1 | H7A2 | 119.5° | 123.9° |
| C7A | C7B | C7C | H7B1 | 125.2° | 118.4° |
| C7A | C7B | C7C | H7B2 | 125.2° | 118.4° |
| C7A | C7B | H7B1 | H7B2 | 117.5° | 123.2° |
| C7A | C7B | C7C | N8 | 14.3° | 22.2° |
| C7A | C7B | C7C | H7C1 | 110.9° | 97.2° |
| C7A | C7B | C7C | H7C2 | 139.6° | 141.6° |
| H7A1 | C7A | C7B | C7C | 112.1° | 82.5° |
| H7A1 | C7A | C7B | H7B1 | 13.1° | 35.9° |
| H7A1 | C7A | C7B | H7B2 | 122.6° | 159.1° |
| H7A2 | C7A | C7B | C7C | 138.4° | 153.6° |
| H7A2 | C7A | C7B | H7B1 | 96.4° | 88.0° |
| H7A2 | C7A | C7B | H7B2 | 13.1° | 35.2° |
| C7C | C7B | H7B1 | H7B2 | 117.6° | 123.3° |
| C7B | C7C | N8 | H7C1 | 125.2° | 119.5° |
| C7B | C7C | N8 | H7C2 | 125.3° | 119.4° |
| C7B | C7C | H7C1 | H7C2 | 121.7° | 121.1° |
| C7B | C7C | N8 | C9 | 162.4° | 179.0° |
| H7B1 | C7B | C7C | N8 | 139.5° | 140.6° |
| H7B1 | C7B | C7C | H7C1 | 14.3° | 21.1° |
| H7B1 | C7B | C7C | H7C2 | 95.2° | 100.0° |
| H7B2 | C7B | C7C | N8 | 110.9° | 96.1° |
| H7B2 | C7B | C7C | H7C1 | 123.9° | 144.4° |
| H7B2 | C7B | C7C | H7C2 | 14.4° | 23.3° |
| N8 | C7C | H7C1 | H7C2 | 121.6° | 121.0° |
| C7C | N8 | C9 | O9 | 164.1° | 174.5° |
| C7C | N8 | C9 | C10 | 1.1° | 5.5° |
| H7C1 | C7C | N8 | C9 | 72.3° | 59.6° |
| H7C2 | C7C | N8 | C9 | 37.2° | 61.5° |
| N8 | C9 | O9 | C10 | 168.2° | 180.0° |
| N8 | C9 | C10 | N12 | 75.2° | 155.6° |
| N8 | C9 | C10 | C11 | 65.1° | 84.5° |
| N8 | C9 | C10 | H10 | 161.8° | 35.6° |
| O9 | C9 | C10 | N12 | 88.9° | 24.5° |
| O9 | C9 | C10 | C11 | 130.8° | 95.5° |
| O9 | C9 | C10 | H10 | 34.1° | 144.5° |
| C9 | C10 | N12 | C11 | 142.9° | 120.0° |
| C9 | C10 | N12 | H10 | 118.0° | 120.0° |
| C9 | C10 | C11 | H10 | 108.9° | 120.1° |
| C9 | C10 | N12 | C13 | 153.8° | 150.0° |
| C9 | C10 | N12 | HN2 | 26.2° | 29.8° |
| C9 | C10 | C11 | C21 | 2.6° | 174.3° |
| C9 | C10 | C11 | H111 | 122.7° | 65.8° |
| C9 | C10 | C11 | H112 | 127.8° | 54.3° |
| N12 | C10 | C11 | H10 | 116.7° | 120.0° |
| C10 | N12 | C13 | HN2 | 180.0° | 179.8° |
| N12 | C10 | C11 | C21 | 131.8° | 65.8° |
| N12 | C10 | C11 | H111 | 103.0° | 54.2° |
| N12 | C10 | C11 | H112 | 6.6° | 174.2° |
| C10 | N12 | C13 | O13 | 49.3° | 0.0° |
| C10 | N12 | C13 | C14 | 142.9° | 179.9° |
| C11 | C10 | N12 | C13 | 10.9° | 90.0° |
| C11 | C10 | N12 | HN2 | 169.1° | 90.1° |
| C10 | C11 | C21 | H111 | 125.2° | 120.0° |
| C10 | C11 | C21 | H112 | 125.2° | 120.0° |
| C10 | C11 | H111 | H112 | 114.2° | 120.0° |
| C10 | C11 | C21 | C22 | 104.0° | 90.0° |
| C10 | C11 | C21 | C26 | 83.3° | 90.3° |
| H10 | C10 | N12 | C13 | 88.2° | 30.0° |
| H10 | C10 | N12 | HN2 | 91.8° | 149.9° |
| H10 | C10 | C11 | C21 | 111.5° | 54.2° |
| H10 | C10 | C11 | H111 | 13.8° | 174.2° |
| H10 | C10 | C11 | H112 | 123.3° | 65.8° |
| N12 | C13 | O13 | C14 | 168.0° | 180.0° |
| N12 | C13 | C14 | C15 | 125.0° | 180.0° |
| N12 | C13 | C14 | H141 | 109.7° | 60.0° |
| N12 | C13 | C14 | H142 | 0.3° | 60.0° |
| HN2 | N12 | C13 | O13 | 130.7° | 179.8° |
| HN2 | N12 | C13 | C14 | 37.1° | 0.1° |
| C21 | C11 | H111 | H112 | 114.3° | 120.0° |
| C11 | C21 | C22 | C26 | 172.9° | 179.8° |
| C11 | C21 | C22 | C23 | 174.4° | 180.0° |
| C11 | C21 | C22 | H22 | 5.6° | 0.0° |
| C11 | C21 | C26 | C25 | 174.2° | 179.8° |
| C11 | C21 | C26 | H26 | 5.8° | 0.2° |
| H111 | C11 | C21 | C22 | 130.8° | 30.0° |
| H111 | C11 | C21 | C26 | 41.9° | 149.7° |
| H112 | C11 | C21 | C22 | 21.2° | 150.0° |
| H112 | C11 | C21 | C26 | 151.5° | 29.8° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.5° | 0.0° |
| C21 | C22 | C23 | H23 | 179.4° | 180.0° |
| C22 | C21 | C26 | C25 | 1.7° | 0.5° |
| C22 | C21 | C26 | H26 | 178.3° | 180.0° |
| C26 | C21 | C22 | C23 | 1.5° | 0.2° |
| C26 | C21 | C22 | H22 | 178.5° | 179.7° |
| C21 | C26 | C25 | C24 | 0.9° | 0.5° |
| C21 | C26 | C25 | H26 | 180.0° | 179.5° |
| C21 | C26 | C25 | H25 | 179.1° | 179.8° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.3° | 0.0° |
| C22 | C23 | C24 | H24 | 179.7° | 179.9° |
| H22 | C22 | C23 | C24 | 179.5° | 180.0° |
| H22 | C22 | C23 | H23 | 0.5° | 0.1° |
| C23 | C24 | C25 | H24 | 179.9° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.2° |
| C23 | C24 | C25 | H25 | 179.9° | 180.0° |
| H23 | C23 | C24 | C25 | 179.8° | 180.0° |
| H23 | C23 | C24 | H24 | 0.3° | 0.1° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | H26 | 179.1° | 180.0° |
| H24 | C24 | C25 | C26 | 179.8° | 179.9° |
| H24 | C24 | C25 | H25 | 0.1° | 0.1° |
| H25 | C25 | C26 | H26 | 0.9° | 0.2° |
| O13 | C13 | C14 | C15 | 42.0° | 0.0° |
| O13 | C13 | C14 | H141 | 83.3° | 119.9° |
| O13 | C13 | C14 | H142 | 167.3° | 120.1° |
| C13 | C14 | C15 | H141 | 125.3° | 120.0° |
| C13 | C14 | C15 | H142 | 125.3° | 120.0° |
| C13 | C14 | H141 | H142 | 114.9° | 120.0° |
| C13 | C14 | C15 | C16 | 77.6° | 180.0° |
| C13 | C14 | C15 | H151 | 47.7° | 60.0° |
| C13 | C14 | C15 | H152 | 157.2° | 60.0° |
| C15 | C14 | H141 | H142 | 114.9° | 120.0° |
| C14 | C15 | C16 | H151 | 125.3° | 120.0° |
| C14 | C15 | C16 | H152 | 125.3° | 120.0° |
| C14 | C15 | H151 | H152 | 114.8° | 120.0° |
| C14 | C15 | C16 | C17 | 121.2° | 180.0° |
| C14 | C15 | C16 | H161 | 4.1° | 60.0° |
| C14 | C15 | C16 | H162 | 113.6° | 60.0° |
| H141 | C14 | C15 | C16 | 157.1° | 60.0° |
| H141 | C14 | C15 | H151 | 77.6° | 180.0° |
| H141 | C14 | C15 | H152 | 31.9° | 60.0° |
| H142 | C14 | C15 | C16 | 47.7° | 60.0° |
| H142 | C14 | C15 | H151 | 172.9° | 60.0° |
| H142 | C14 | C15 | H152 | 77.5° | 180.0° |
| C16 | C15 | H151 | H152 | 114.7° | 120.0° |
| C15 | C16 | C17 | H161 | 125.3° | 120.0° |
| C15 | C16 | C17 | H162 | 125.3° | 120.1° |
| C15 | C16 | H161 | H162 | 116.7° | 120.1° |
| C15 | C16 | C17 | O17 | 121.0° | 120.0° |
| C15 | C16 | C17 | H17 | 59.0° | 59.9° |
| H151 | C15 | C16 | C17 | 113.6° | 60.0° |
| H151 | C15 | C16 | H161 | 121.2° | 180.0° |
| H151 | C15 | C16 | H162 | 11.7° | 60.0° |
| H152 | C15 | C16 | C17 | 4.1° | 60.0° |
| H152 | C15 | C16 | H161 | 129.3° | 60.0° |
| H152 | C15 | C16 | H162 | 121.2° | 180.0° |
| C17 | C16 | H161 | H162 | 116.6° | 119.9° |
| C16 | C17 | O17 | H17 | 180.0° | 179.9° |
| H161 | C16 | C17 | O17 | 4.2° | 0.1° |
| H161 | C16 | C17 | H17 | 175.7° | 180.0° |
| H162 | C16 | C17 | O17 | 113.7° | 120.0° |
| H162 | C16 | C17 | H17 | 66.2° | 60.1° |
