DI5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| B1 | C | sing | 1.57Å | 1.59Å | |
| B1 | O | sing | 1.42Å | 1.44Å | |
| B1 | O1 | sing | 1.42Å | 1.44Å | |
| C | C2 | sing | 1.53Å | 1.54Å | |
| C | N | sing | 1.46Å | 1.50Å | |
| C | H | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| C4 | N1 | sing | 1.47Å | 1.49Å | |
| C4 | H41 | sing | 1.09Å | 1.12Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C6 | C5 | sing | 1.51Å | 1.56Å | |
| C6 | N | sing | 1.35Å | 1.34Å | |
| C6 | O2 | doub | 1.21Å | 1.23Å | |
| C5 | C7 | sing | 1.54Å | 1.55Å | |
| C5 | N2 | sing | 1.47Å | 1.50Å | |
| C5 | H5 | sing | 1.09Å | 1.11Å | |
| C7 | C8 | sing | 1.55Å | 1.53Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.12Å | |
| C8 | C9 | sing | 1.55Å | 1.52Å | |
| C8 | H81 | sing | 1.09Å | 1.12Å | |
| C8 | H82 | sing | 1.09Å | 1.11Å | |
| C9 | N2 | sing | 1.47Å | 1.47Å | |
| C9 | H91 | sing | 1.09Å | 1.11Å | |
| C9 | H92 | sing | 1.09Å | 1.11Å | |
| C10 | C12 | sing | 1.51Å | 1.59Å | |
| C10 | N2 | sing | 1.35Å | 1.35Å | |
| C10 | O3 | doub | 1.21Å | 1.23Å | |
| C11 | C12 | sing | 1.53Å | 1.58Å | |
| C11 | C19 | sing | 1.51Å | 1.55Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | N3 | sing | 1.47Å | 1.49Å | |
| C12 | H12 | sing | 1.09Å | 1.11Å | |
| C13 | C14 | sing | 1.51Å | 1.53Å | |
| C13 | N3 | sing | 1.35Å | 1.35Å | |
| C13 | O4 | doub | 1.21Å | 1.24Å | |
| C14 | H141 | sing | 1.09Å | 1.12Å | |
| C14 | H142 | sing | 1.09Å | 1.11Å | |
| C14 | H143 | sing | 1.09Å | 1.12Å | |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.10Å | |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.10Å | |
| C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.10Å | |
| C18 | C19 | sing | 1.38Å | 1.41Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.10Å | |
| C19 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.10Å | |
| N | HN | sing | 0.97Å | 1.02Å | |
| N1 | HN11 | sing | 1.01Å | 1.02Å | |
| N1 | HN12 | sing | 1.01Å | 1.02Å | |
| N3 | HN3 | sing | 0.97Å | 1.02Å | |
| O | HO | sing | 0.97Å | 0.95Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | B1 | O | 111.1° | 120.0° |
| C | B1 | O1 | 113.9° | 120.0° |
| B1 | C | C2 | 106.0° | 109.4° |
| B1 | C | N | 109.7° | 109.5° |
| B1 | C | H | 112.0° | 109.4° |
| O | B1 | O1 | 106.7° | 120.0° |
| B1 | O | HO | 111.1° | 106.8° |
| B1 | O1 | HO1 | 113.9° | 106.8° |
| C2 | C | N | 110.9° | 109.5° |
| C2 | C | H | 110.9° | 109.5° |
| C | C2 | C3 | 119.7° | 109.5° |
| C | C2 | H21 | 108.5° | 109.4° |
| C | C2 | H22 | 108.5° | 109.5° |
| N | C | H | 107.3° | 109.5° |
| C | N | C6 | 124.8° | 120.0° |
| C | N | HN | 123.6° | 120.0° |
| C3 | C2 | H21 | 108.5° | 109.4° |
| C3 | C2 | H22 | 108.5° | 109.5° |
| C2 | C3 | C4 | 115.2° | 109.5° |
| C2 | C3 | H31 | 110.1° | 109.4° |
| C2 | C3 | H32 | 110.1° | 109.5° |
| H21 | C2 | H22 | 101.4° | 109.5° |
| C4 | C3 | H31 | 110.1° | 109.4° |
| C4 | C3 | H32 | 110.1° | 109.5° |
| C3 | C4 | N1 | 109.5° | 109.5° |
| C3 | C4 | H41 | 112.2° | 109.4° |
| C3 | C4 | H42 | 112.2° | 109.5° |
| H31 | C3 | H32 | 100.1° | 109.5° |
| N1 | C4 | H41 | 112.2° | 109.5° |
| N1 | C4 | H42 | 112.2° | 109.5° |
| C4 | N1 | HN11 | 109.5° | 106.7° |
| C4 | N1 | HN12 | 112.2° | 106.7° |
| H41 | C4 | H42 | 98.2° | 109.5° |
| C5 | C6 | N | 117.4° | 120.0° |
| C5 | C6 | O2 | 119.6° | 119.9° |
| C6 | C5 | C7 | 110.1° | 109.9° |
| C6 | C5 | N2 | 116.0° | 110.3° |
| C6 | C5 | H5 | 102.8° | 109.9° |
| N | C6 | O2 | 123.0° | 120.1° |
| C6 | N | HN | 111.6° | 120.0° |
| C7 | C5 | N2 | 103.6° | 107.3° |
| C7 | C5 | H5 | 115.4° | 109.9° |
| C5 | C7 | C8 | 107.7° | 103.1° |
| C5 | C7 | H71 | 112.9° | 110.9° |
| C5 | C7 | H72 | 112.9° | 110.5° |
| N2 | C5 | H5 | 109.4° | 109.6° |
| C5 | N2 | C9 | 113.2° | 108.7° |
| C5 | N2 | C10 | 121.9° | 125.7° |
| C8 | C7 | H71 | 112.9° | 110.8° |
| C8 | C7 | H72 | 112.9° | 110.7° |
| C7 | C8 | C9 | 106.4° | 101.6° |
| C7 | C8 | H81 | 113.3° | 111.0° |
| C7 | C8 | H82 | 113.3° | 111.0° |
| H71 | C7 | H72 | 97.6° | 110.7° |
| C9 | C8 | H81 | 113.3° | 111.0° |
| C9 | C8 | H82 | 113.4° | 111.1° |
| C8 | C9 | N2 | 105.9° | 104.9° |
| C8 | C9 | H91 | 113.6° | 110.4° |
| C8 | C9 | H92 | 113.6° | 110.3° |
| H81 | C8 | H82 | 97.1° | 110.9° |
| N2 | C9 | H91 | 113.5° | 110.5° |
| N2 | C9 | H92 | 113.5° | 110.3° |
| C9 | N2 | C10 | 124.9° | 125.6° |
| H91 | C9 | H92 | 97.0° | 110.3° |
| C12 | C10 | N2 | 122.7° | 120.0° |
| C12 | C10 | O3 | 116.7° | 120.1° |
| C10 | C12 | C11 | 109.6° | 109.5° |
| C10 | C12 | N3 | 105.5° | 109.4° |
| C10 | C12 | H12 | 112.1° | 109.5° |
| N2 | C10 | O3 | 120.6° | 119.9° |
| C12 | C11 | C19 | 117.7° | 109.5° |
| C12 | C11 | H111 | 109.2° | 109.4° |
| C12 | C11 | H112 | 109.2° | 109.5° |
| C11 | C12 | N3 | 110.2° | 109.4° |
| C11 | C12 | H12 | 107.7° | 109.5° |
| C19 | C11 | H111 | 109.2° | 109.5° |
| C19 | C11 | H112 | 109.3° | 109.5° |
| C11 | C19 | C18 | 119.7° | 120.0° |
| C11 | C19 | C20 | 121.8° | 120.0° |
| H111 | C11 | H112 | 100.9° | 109.5° |
| N3 | C12 | H12 | 111.6° | 109.4° |
| C12 | N3 | C13 | 122.9° | 120.0° |
| C12 | N3 | HN3 | 123.6° | 120.0° |
| C14 | C13 | N3 | 118.7° | 120.0° |
| C14 | C13 | O4 | 118.2° | 120.0° |
| C13 | C14 | H141 | 118.7° | 109.5° |
| C13 | C14 | H142 | 108.9° | 109.5° |
| C13 | C14 | H143 | 108.9° | 109.5° |
| N3 | C13 | O4 | 123.1° | 120.0° |
| C13 | N3 | HN3 | 113.5° | 120.0° |
| H141 | C14 | H142 | 109.0° | 109.5° |
| H141 | C14 | H143 | 108.9° | 109.4° |
| H142 | C14 | H143 | 101.1° | 109.4° |
| C16 | C15 | C20 | 120.1° | 120.0° |
| C16 | C15 | H15 | 119.8° | 120.0° |
| C15 | C16 | C17 | 120.3° | 120.0° |
| C15 | C16 | H16 | 119.3° | 120.1° |
| C20 | C15 | H15 | 120.2° | 120.0° |
| C15 | C20 | C19 | 120.7° | 120.0° |
| C15 | C20 | H20 | 118.9° | 120.0° |
| C17 | C16 | H16 | 120.5° | 119.9° |
| C16 | C17 | C18 | 119.8° | 120.0° |
| C16 | C17 | H17 | 120.5° | 120.1° |
| C18 | C17 | H17 | 119.8° | 120.0° |
| C17 | C18 | C19 | 120.8° | 120.0° |
| C17 | C18 | H18 | 119.2° | 120.0° |
| C19 | C18 | H18 | 120.0° | 120.1° |
| C18 | C19 | C20 | 118.4° | 120.0° |
| C19 | C20 | H20 | 120.3° | 120.0° |
| HN11 | N1 | HN12 | 112.2° | 106.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | B1 | O | O1 | 124.6° | 179.9° |
| B1 | C | C2 | N | 119.0° | 120.0° |
| B1 | C | C2 | H | 121.8° | 119.9° |
| B1 | C | N | H | 121.9° | 120.0° |
| B1 | C | C2 | C3 | 177.3° | 60.0° |
| B1 | C | C2 | H21 | 52.0° | 180.0° |
| B1 | C | C2 | H22 | 57.4° | 60.1° |
| B1 | C | N | C6 | 111.5° | 90.0° |
| B1 | C | N | HN | 68.5° | 90.1° |
| C | B1 | O | HO | 180.0° | 180.0° |
| C | B1 | O1 | HO1 | 180.0° | 0.1° |
| O | B1 | C | C2 | 66.5° | 60.0° |
| O | B1 | C | N | 173.7° | 60.0° |
| O | B1 | C | H | 54.6° | 180.0° |
| O | B1 | O1 | HO1 | 57.1° | 180.0° |
| O1 | B1 | C | C2 | 173.0° | 119.9° |
| O1 | B1 | C | N | 53.2° | 120.0° |
| O1 | B1 | C | H | 65.9° | 0.0° |
| O1 | B1 | O | HO | 55.4° | 0.0° |
| C2 | C | N | H | 121.3° | 120.1° |
| C | C2 | C3 | H21 | 125.3° | 119.9° |
| C | C2 | C3 | H22 | 125.3° | 120.1° |
| C | C2 | H21 | H22 | 114.2° | 120.0° |
| C | C2 | C3 | C4 | 72.0° | 180.0° |
| C | C2 | C3 | H31 | 53.3° | 60.1° |
| C | C2 | C3 | H32 | 162.8° | 60.0° |
| C2 | C | N | C6 | 131.8° | 150.0° |
| C2 | C | N | HN | 48.3° | 29.9° |
| N | C | C2 | C3 | 58.3° | 180.0° |
| N | C | C2 | H21 | 67.0° | 60.0° |
| N | C | C2 | H22 | 176.4° | 60.0° |
| C | N | C6 | C5 | 176.3° | 180.0° |
| C | N | C6 | HN | 180.0° | 180.0° |
| C | N | C6 | O2 | 3.8° | 0.0° |
| H | C | C2 | C3 | 60.8° | 59.9° |
| H | C | C2 | H21 | 173.9° | 60.0° |
| H | C | C2 | H22 | 64.4° | 180.0° |
| H | C | N | C6 | 10.5° | 30.0° |
| H | C | N | HN | 169.5° | 150.0° |
| C3 | C2 | H21 | H22 | 114.2° | 120.0° |
| C2 | C3 | C4 | H31 | 125.3° | 120.0° |
| C2 | C3 | C4 | H32 | 125.2° | 120.0° |
| C2 | C3 | H31 | H32 | 115.9° | 120.0° |
| C2 | C3 | C4 | N1 | 138.7° | 180.0° |
| C2 | C3 | C4 | H41 | 13.4° | 60.1° |
| C2 | C3 | C4 | H42 | 96.0° | 60.0° |
| H21 | C2 | C3 | C4 | 162.7° | 60.0° |
| H21 | C2 | C3 | H31 | 72.0° | 180.0° |
| H21 | C2 | C3 | H32 | 37.5° | 60.0° |
| H22 | C2 | C3 | C4 | 53.3° | 59.9° |
| H22 | C2 | C3 | H31 | 178.6° | 60.0° |
| H22 | C2 | C3 | H32 | 71.9° | 179.9° |
| C4 | C3 | H31 | H32 | 116.0° | 120.0° |
| C3 | C4 | N1 | H41 | 125.2° | 120.0° |
| C3 | C4 | N1 | H42 | 125.3° | 120.0° |
| C3 | C4 | H41 | H42 | 118.1° | 120.0° |
| C3 | C4 | N1 | HN11 | 180.0° | 180.0° |
| C3 | C4 | N1 | HN12 | 54.8° | 66.3° |
| H31 | C3 | C4 | N1 | 96.0° | 60.0° |
| H31 | C3 | C4 | H41 | 138.7° | 180.0° |
| H31 | C3 | C4 | H42 | 29.2° | 60.0° |
| H32 | C3 | C4 | N1 | 13.5° | 60.0° |
| H32 | C3 | C4 | H41 | 111.8° | 60.0° |
| H32 | C3 | C4 | H42 | 138.8° | 180.0° |
| N1 | C4 | H41 | H42 | 118.1° | 120.0° |
| C4 | N1 | HN11 | HN12 | 125.2° | 113.8° |
| H41 | C4 | N1 | HN11 | 54.7° | 60.0° |
| H41 | C4 | N1 | HN12 | 70.5° | 173.8° |
| H42 | C4 | N1 | HN11 | 54.7° | 60.0° |
| H42 | C4 | N1 | HN12 | 180.0° | 53.7° |
| C5 | C6 | N | O2 | 179.9° | 180.0° |
| C6 | C5 | C7 | N2 | 124.6° | 119.9° |
| C6 | C5 | C7 | H5 | 115.8° | 121.0° |
| C6 | C5 | N2 | H5 | 115.7° | 121.1° |
| C6 | C5 | C7 | C8 | 112.8° | 141.7° |
| C6 | C5 | C7 | H71 | 12.5° | 99.7° |
| C6 | C5 | C7 | H72 | 121.9° | 23.4° |
| C6 | C5 | N2 | C9 | 119.4° | 118.3° |
| C6 | C5 | N2 | C10 | 59.5° | 61.6° |
| C5 | C6 | N | HN | 3.7° | 0.0° |
| N | C6 | C5 | C7 | 100.0° | 61.5° |
| N | C6 | C5 | N2 | 142.8° | 179.5° |
| N | C6 | C5 | H5 | 23.4° | 59.6° |
| O2 | C6 | C5 | C7 | 80.1° | 118.5° |
| O2 | C6 | C5 | N2 | 37.1° | 0.5° |
| O2 | C6 | C5 | H5 | 156.5° | 120.4° |
| O2 | C6 | N | HN | 176.2° | 180.0° |
| C7 | C5 | N2 | H5 | 123.6° | 119.3° |
| C5 | C7 | C8 | H71 | 125.3° | 118.6° |
| C5 | C7 | C8 | H72 | 125.3° | 118.2° |
| C5 | C7 | H71 | H72 | 118.8° | 123.0° |
| C5 | C7 | C8 | C9 | 17.9° | 35.2° |
| C5 | C7 | C8 | H81 | 107.3° | 82.8° |
| C5 | C7 | C8 | H82 | 143.2° | 153.4° |
| C7 | C5 | N2 | C9 | 1.3° | 1.3° |
| C7 | C5 | N2 | C10 | 179.7° | 178.8° |
| N2 | C5 | C7 | C8 | 11.9° | 21.9° |
| N2 | C5 | C7 | H71 | 137.1° | 140.4° |
| N2 | C5 | C7 | H72 | 113.4° | 96.5° |
| C5 | N2 | C9 | C8 | 9.7° | 24.2° |
| C5 | N2 | C9 | C10 | 178.9° | 179.9° |
| C5 | N2 | C9 | H91 | 134.9° | 143.2° |
| C5 | N2 | C9 | H92 | 115.5° | 94.5° |
| C5 | N2 | C10 | C12 | 179.9° | 179.8° |
| C5 | N2 | C10 | O3 | 1.3° | 0.2° |
| H5 | C5 | C7 | C8 | 131.4° | 97.2° |
| H5 | C5 | C7 | H71 | 103.3° | 21.3° |
| H5 | C5 | C7 | H72 | 6.1° | 144.5° |
| H5 | C5 | N2 | C9 | 124.9° | 120.6° |
| H5 | C5 | N2 | C10 | 56.2° | 59.5° |
| C8 | C7 | H71 | H72 | 118.8° | 123.2° |
| C7 | C8 | C9 | H81 | 125.2° | 118.0° |
| C7 | C8 | C9 | H82 | 125.3° | 118.1° |
| C7 | C8 | H81 | H82 | 119.3° | 123.9° |
| C7 | C8 | C9 | N2 | 16.7° | 36.9° |
| C7 | C8 | C9 | H91 | 141.9° | 155.9° |
| C7 | C8 | C9 | H92 | 108.5° | 81.9° |
| H71 | C7 | C8 | C9 | 143.2° | 153.8° |
| H71 | C7 | C8 | H81 | 18.0° | 35.8° |
| H71 | C7 | C8 | H82 | 91.5° | 88.0° |
| H72 | C7 | C8 | C9 | 107.3° | 82.9° |
| H72 | C7 | C8 | H81 | 127.4° | 159.1° |
| H72 | C7 | C8 | H82 | 18.0° | 35.2° |
| C9 | C8 | H81 | H82 | 119.3° | 123.9° |
| C8 | C9 | N2 | H91 | 125.2° | 119.0° |
| C8 | C9 | N2 | H92 | 125.3° | 118.8° |
| C8 | C9 | H91 | H92 | 119.5° | 122.2° |
| C8 | C9 | N2 | C10 | 169.2° | 155.9° |
| H81 | C8 | C9 | N2 | 108.5° | 81.1° |
| H81 | C8 | C9 | H91 | 16.7° | 37.9° |
| H81 | C8 | C9 | H92 | 126.3° | 160.1° |
| H82 | C8 | C9 | N2 | 142.0° | 155.0° |
| H82 | C8 | C9 | H91 | 92.8° | 85.9° |
| H82 | C8 | C9 | H92 | 16.8° | 36.2° |
| N2 | C9 | H91 | H92 | 119.5° | 122.3° |
| C9 | N2 | C10 | C12 | 1.3° | 0.0° |
| C9 | N2 | C10 | O3 | 179.9° | 180.0° |
| H91 | C9 | N2 | C10 | 43.9° | 36.9° |
| H92 | C9 | N2 | C10 | 65.6° | 85.3° |
| C12 | C10 | N2 | O3 | 178.6° | 180.0° |
| C10 | C12 | C11 | N3 | 115.7° | 120.0° |
| C10 | C12 | C11 | H12 | 122.3° | 120.1° |
| C10 | C12 | C11 | C19 | 73.4° | 180.0° |
| C10 | C12 | C11 | H111 | 51.8° | 60.1° |
| C10 | C12 | C11 | H112 | 161.3° | 59.9° |
| C10 | C12 | N3 | H12 | 122.1° | 120.0° |
| C10 | C12 | N3 | C13 | 98.3° | 60.0° |
| C10 | C12 | N3 | HN3 | 81.7° | 120.0° |
| N2 | C10 | C12 | C11 | 102.4° | 90.0° |
| N2 | C10 | C12 | N3 | 139.0° | 150.0° |
| N2 | C10 | C12 | H12 | 17.2° | 30.0° |
| O3 | C10 | C12 | C11 | 76.3° | 90.0° |
| O3 | C10 | C12 | N3 | 42.4° | 30.0° |
| O3 | C10 | C12 | H12 | 164.1° | 150.0° |
| C12 | C11 | C19 | H111 | 125.2° | 120.0° |
| C12 | C11 | C19 | H112 | 125.3° | 120.0° |
| C12 | C11 | H111 | H112 | 114.9° | 120.0° |
| C11 | C12 | N3 | H12 | 119.7° | 120.0° |
| C11 | C12 | N3 | C13 | 143.5° | 60.0° |
| C12 | C11 | C19 | C18 | 136.7° | 90.0° |
| C12 | C11 | C19 | C20 | 45.4° | 90.3° |
| C11 | C12 | N3 | HN3 | 36.6° | 119.9° |
| C19 | C11 | H111 | H112 | 115.0° | 120.0° |
| C19 | C11 | C12 | N3 | 170.9° | 60.0° |
| C19 | C11 | C12 | H12 | 48.9° | 59.9° |
| C11 | C19 | C20 | C15 | 179.0° | 179.9° |
| C11 | C19 | C18 | C17 | 178.0° | 180.0° |
| C11 | C19 | C18 | C20 | 178.0° | 179.7° |
| C11 | C19 | C18 | H18 | 2.0° | 0.1° |
| C11 | C19 | C20 | H20 | 1.1° | 0.2° |
| H111 | C11 | C12 | N3 | 63.9° | 180.0° |
| H111 | C11 | C12 | H12 | 174.1° | 60.0° |
| H111 | C11 | C19 | C18 | 11.5° | 29.9° |
| H111 | C11 | C19 | C20 | 170.6° | 149.7° |
| H112 | C11 | C12 | N3 | 45.6° | 60.0° |
| H112 | C11 | C12 | H12 | 76.4° | 180.0° |
| H112 | C11 | C19 | C18 | 98.0° | 149.9° |
| H112 | C11 | C19 | C20 | 79.8° | 29.8° |
| C12 | N3 | C13 | C14 | 178.0° | 180.0° |
| C12 | N3 | C13 | HN3 | 179.9° | 179.9° |
| C12 | N3 | C13 | O4 | 3.1° | 0.0° |
| H12 | C12 | N3 | C13 | 23.8° | 180.0° |
| H12 | C12 | N3 | HN3 | 156.3° | 0.0° |
| C14 | C13 | N3 | O4 | 178.9° | 180.0° |
| C13 | C14 | H141 | H142 | 125.3° | 120.1° |
| C13 | C14 | H141 | H143 | 125.2° | 120.0° |
| C13 | C14 | H142 | H143 | 114.6° | 119.9° |
| C14 | C13 | N3 | HN3 | 2.0° | 0.0° |
| N3 | C13 | C14 | H141 | 180.0° | 180.0° |
| N3 | C13 | C14 | H142 | 54.7° | 59.9° |
| N3 | C13 | C14 | H143 | 54.7° | 60.0° |
| O4 | C13 | C14 | H141 | 1.1° | 0.0° |
| O4 | C13 | C14 | H142 | 124.2° | 120.1° |
| O4 | C13 | C14 | H143 | 126.3° | 120.0° |
| O4 | C13 | N3 | HN3 | 176.9° | 179.9° |
| H141 | C14 | H142 | H143 | 114.6° | 120.0° |
| C16 | C15 | C20 | H15 | 179.9° | 179.9° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.9° | 0.0° |
| C15 | C16 | C17 | H17 | 179.2° | 180.0° |
| C16 | C15 | C20 | C19 | 1.1° | 0.4° |
| C16 | C15 | C20 | H20 | 178.9° | 180.0° |
| C20 | C15 | C16 | C17 | 0.1° | 0.2° |
| C20 | C15 | C16 | H16 | 179.9° | 179.9° |
| C15 | C20 | C19 | C18 | 1.1° | 0.5° |
| C15 | C20 | C19 | H20 | 179.9° | 179.7° |
| H15 | C15 | C16 | C17 | 179.8° | 179.9° |
| H15 | C15 | C16 | H16 | 0.2° | 0.0° |
| H15 | C15 | C20 | C19 | 178.8° | 179.7° |
| H15 | C15 | C20 | H20 | 1.1° | 0.1° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.9° | 0.1° |
| C16 | C17 | C18 | H18 | 179.0° | 180.0° |
| H16 | C16 | C17 | C18 | 179.1° | 180.0° |
| H16 | C16 | C17 | H17 | 0.9° | 0.0° |
| C17 | C18 | C19 | H18 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 0.0° | 0.3° |
| H17 | C17 | C18 | C19 | 179.1° | 179.9° |
| H17 | C17 | C18 | H18 | 0.9° | 0.0° |
| C18 | C19 | C20 | H20 | 179.0° | 179.9° |
| H18 | C18 | C19 | C20 | 180.0° | 179.8° |
