180
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.34Å | 1.21Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C1 | O2 | doub | 1.21Å | 1.20Å | |
| C1 | C2 | sing | 1.51Å | 1.48Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | N3 | sing | 1.46Å | 1.47Å | |
| C2 | H2 | sing | 1.09Å | 1.12Å | |
| C3 | N1 | sing | 1.46Å | 1.45Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.11Å | |
| N1 | C4 | sing | 1.35Å | 1.31Å | |
| N1 | HN1 | sing | 0.97Å | 1.02Å | |
| C4 | O3 | doub | 1.22Å | 1.21Å | |
| C4 | C5 | sing | 1.46Å | 1.45Å | |
| C5 | C6 | doub | 1.36Å | 1.35Å | Aromatic |
| C5 | S2 | sing | 1.78Å | 1.77Å | Aromatic |
| C6 | C7 | sing | 1.42Å | 1.40Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | sing | 1.47Å | 1.46Å | Aromatic |
| C7 | C17 | doub | 1.41Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.34Å | 1.31Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| C9 | C10 | sing | 1.51Å | 1.49Å | |
| C9 | S1 | sing | 1.78Å | 1.77Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | H101 | sing | 1.09Å | 1.12Å | |
| C10 | H102 | sing | 1.09Å | 1.12Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | C13 | sing | 1.53Å | 1.51Å | |
| C12 | C16 | sing | 1.53Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.12Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | H131 | sing | 1.09Å | 1.12Å | |
| C13 | H132 | sing | 1.09Å | 1.11Å | |
| C14 | N2 | sing | 1.47Å | 1.48Å | |
| C14 | H141 | sing | 1.09Å | 1.11Å | |
| C14 | H142 | sing | 1.09Å | 1.11Å | |
| N2 | C15 | sing | 1.47Å | 1.47Å | |
| N2 | HN2 | sing | 1.01Å | 1.02Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C15 | H151 | sing | 1.09Å | 1.11Å | |
| C15 | H152 | sing | 1.09Å | 1.11Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| S1 | C17 | sing | 1.76Å | 1.74Å | Aromatic |
| C17 | S2 | sing | 1.76Å | 1.76Å | Aromatic |
| N3 | S3 | sing | 1.65Å | 1.66Å | |
| N3 | HN3 | sing | 0.97Å | 1.02Å | |
| S3 | O4 | doub | 1.42Å | 1.40Å | |
| S3 | O5 | doub | 1.42Å | 1.42Å | |
| S3 | C18 | sing | 1.76Å | 1.75Å | |
| C18 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.10Å | |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.10Å | |
| C21 | N4 | sing | 1.32Å | 1.33Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.10Å | |
| N4 | C22 | doub | 1.32Å | 1.32Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O1 | HO1 | 120.1° | 120.0° |
| O1 | C1 | O2 | 120.1° | 119.9° |
| O1 | C1 | C2 | 119.9° | 120.0° |
| O2 | C1 | C2 | 120.0° | 120.1° |
| C1 | C2 | C3 | 110.5° | 109.5° |
| C1 | C2 | N3 | 110.7° | 109.5° |
| C1 | C2 | H2 | 108.5° | 109.4° |
| C3 | C2 | N3 | 111.1° | 109.5° |
| C3 | C2 | H2 | 108.0° | 109.4° |
| C2 | C3 | N1 | 107.1° | 109.4° |
| C2 | C3 | H31 | 113.1° | 109.5° |
| C2 | C3 | H32 | 113.1° | 109.5° |
| N3 | C2 | H2 | 107.9° | 109.5° |
| C2 | N3 | S3 | 119.0° | 120.0° |
| C2 | N3 | HN3 | 108.8° | 120.0° |
| N1 | C3 | H31 | 113.1° | 109.5° |
| N1 | C3 | H32 | 113.1° | 109.4° |
| C3 | N1 | C4 | 118.5° | 120.0° |
| C3 | N1 | HN1 | 125.8° | 120.1° |
| H31 | C3 | H32 | 97.4° | 109.5° |
| C4 | N1 | HN1 | 115.7° | 119.9° |
| N1 | C4 | O3 | 118.2° | 120.0° |
| N1 | C4 | C5 | 121.1° | 120.0° |
| O3 | C4 | C5 | 120.3° | 120.0° |
| C4 | C5 | C6 | 127.2° | 128.7° |
| C4 | C5 | S2 | 130.2° | 128.8° |
| C6 | C5 | S2 | 102.6° | 102.5° |
| C5 | C6 | C7 | 121.1° | 120.7° |
| C5 | C6 | H6 | 117.7° | 119.6° |
| C5 | S2 | C17 | 97.7° | 98.0° |
| C7 | C6 | H6 | 121.2° | 119.7° |
| C6 | C7 | C8 | 133.3° | 133.9° |
| C6 | C7 | C17 | 113.4° | 113.5° |
| C8 | C7 | C17 | 113.2° | 112.5° |
| C7 | C8 | C9 | 119.9° | 120.1° |
| C7 | C8 | H8 | 125.3° | 120.0° |
| C7 | C17 | S1 | 104.8° | 105.4° |
| C7 | C17 | S2 | 105.2° | 105.2° |
| C9 | C8 | H8 | 114.8° | 119.9° |
| C8 | C9 | C10 | 128.0° | 128.3° |
| C8 | C9 | S1 | 103.3° | 103.2° |
| C10 | C9 | S1 | 128.7° | 128.4° |
| C9 | C10 | C11 | 108.7° | 109.5° |
| C9 | C10 | H101 | 112.5° | 109.5° |
| C9 | C10 | H102 | 112.5° | 109.5° |
| C9 | S1 | C17 | 98.7° | 98.7° |
| C11 | C10 | H101 | 112.5° | 109.4° |
| C11 | C10 | H102 | 112.5° | 109.5° |
| C10 | C11 | C12 | 108.5° | 109.5° |
| C10 | C11 | H111 | 112.6° | 109.5° |
| C10 | C11 | H112 | 112.6° | 109.5° |
| H101 | C10 | H102 | 97.9° | 109.4° |
| C12 | C11 | H111 | 112.6° | 109.4° |
| C12 | C11 | H112 | 112.5° | 109.5° |
| C11 | C12 | C13 | 109.7° | 109.6° |
| C11 | C12 | C16 | 110.1° | 109.5° |
| C11 | C12 | H12 | 108.8° | 109.5° |
| H111 | C11 | H112 | 97.9° | 109.4° |
| C13 | C12 | C16 | 109.2° | 108.9° |
| C13 | C12 | H12 | 109.8° | 109.5° |
| C12 | C13 | C14 | 107.3° | 109.2° |
| C12 | C13 | H131 | 113.0° | 109.5° |
| C12 | C13 | H132 | 113.0° | 109.5° |
| C16 | C12 | H12 | 109.3° | 109.7° |
| C12 | C16 | C15 | 108.5° | 109.2° |
| C12 | C16 | H161 | 112.6° | 109.6° |
| C12 | C16 | H162 | 112.5° | 109.5° |
| C14 | C13 | H131 | 113.0° | 109.5° |
| C14 | C13 | H132 | 113.0° | 109.5° |
| C13 | C14 | N2 | 110.1° | 109.8° |
| C13 | C14 | H141 | 112.0° | 109.4° |
| C13 | C14 | H142 | 112.0° | 109.4° |
| H131 | C13 | H132 | 97.5° | 109.5° |
| N2 | C14 | H141 | 112.0° | 109.4° |
| N2 | C14 | H142 | 112.0° | 109.4° |
| C14 | N2 | C15 | 109.1° | 107.3° |
| C14 | N2 | HN2 | 112.3° | 106.8° |
| H141 | C14 | H142 | 98.4° | 109.4° |
| C15 | N2 | HN2 | 112.3° | 106.7° |
| N2 | C15 | C16 | 110.0° | 109.8° |
| N2 | C15 | H151 | 112.0° | 109.4° |
| N2 | C15 | H152 | 112.0° | 109.5° |
| C16 | C15 | H151 | 112.0° | 109.4° |
| C16 | C15 | H152 | 112.0° | 109.4° |
| C15 | C16 | H161 | 112.6° | 109.5° |
| C15 | C16 | H162 | 112.6° | 109.5° |
| H151 | C15 | H152 | 98.4° | 109.3° |
| H161 | C16 | H162 | 97.9° | 109.5° |
| S1 | C17 | S2 | 150.0° | 149.4° |
| S3 | N3 | HN3 | 108.8° | 120.0° |
| N3 | S3 | O4 | 106.9° | 105.8° |
| N3 | S3 | O5 | 103.4° | 105.8° |
| N3 | S3 | C18 | 110.3° | 107.4° |
| O4 | S3 | O5 | 122.3° | 125.4° |
| O4 | S3 | C18 | 107.4° | 105.8° |
| O5 | S3 | C18 | 106.2° | 105.7° |
| S3 | C18 | C19 | 120.3° | 120.4° |
| S3 | C18 | C22 | 120.3° | 120.4° |
| C19 | C18 | C22 | 119.4° | 119.1° |
| C18 | C19 | C20 | 118.7° | 118.5° |
| C18 | C19 | H19 | 120.7° | 120.7° |
| C18 | C22 | N4 | 120.4° | 120.8° |
| C18 | C22 | H22 | 121.8° | 119.6° |
| C20 | C19 | H19 | 120.7° | 120.8° |
| C19 | C20 | C21 | 118.8° | 119.1° |
| C19 | C20 | H20 | 120.8° | 120.5° |
| C21 | C20 | H20 | 120.4° | 120.4° |
| C20 | C21 | N4 | 120.8° | 120.7° |
| C20 | C21 | H21 | 121.9° | 119.6° |
| N4 | C21 | H21 | 117.4° | 119.7° |
| C21 | N4 | C22 | 122.0° | 121.7° |
| N4 | C22 | H22 | 117.7° | 119.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | O2 | C2 | 179.8° | 180.0° |
| O1 | C1 | C2 | C3 | 27.8° | 90.0° |
| O1 | C1 | C2 | N3 | 95.8° | 30.0° |
| O1 | C1 | C2 | H2 | 146.0° | 150.0° |
| HO1 | O1 | C1 | O2 | 180.0° | 0.0° |
| HO1 | O1 | C1 | C2 | 0.2° | 180.0° |
| O2 | C1 | C2 | C3 | 152.5° | 90.0° |
| O2 | C1 | C2 | N3 | 84.0° | 150.0° |
| O2 | C1 | C2 | H2 | 34.2° | 29.9° |
| C1 | C2 | C3 | N3 | 123.3° | 120.1° |
| C1 | C2 | C3 | H2 | 118.6° | 119.9° |
| C1 | C2 | N3 | H2 | 118.6° | 120.0° |
| C1 | C2 | C3 | N1 | 161.1° | 175.8° |
| C1 | C2 | C3 | H31 | 35.8° | 64.2° |
| C1 | C2 | C3 | H32 | 73.7° | 55.9° |
| C1 | C2 | N3 | S3 | 112.6° | 94.9° |
| C1 | C2 | N3 | HN3 | 12.6° | 85.0° |
| C3 | C2 | N3 | H2 | 118.3° | 120.0° |
| C2 | C3 | N1 | H31 | 125.3° | 120.0° |
| C2 | C3 | N1 | H32 | 125.3° | 120.0° |
| C2 | C3 | H31 | H32 | 119.0° | 120.0° |
| C2 | C3 | N1 | C4 | 113.8° | 174.9° |
| C2 | C3 | N1 | HN1 | 66.2° | 5.1° |
| C3 | C2 | N3 | S3 | 124.2° | 145.0° |
| C3 | C2 | N3 | HN3 | 110.6° | 35.0° |
| N3 | C2 | C3 | N1 | 37.8° | 55.7° |
| N3 | C2 | C3 | H31 | 87.5° | 175.7° |
| N3 | C2 | C3 | H32 | 163.1° | 64.2° |
| C2 | N3 | S3 | HN3 | 125.3° | 179.9° |
| C2 | N3 | S3 | O4 | 142.0° | 177.9° |
| C2 | N3 | S3 | O5 | 11.7° | 47.3° |
| C2 | N3 | S3 | C18 | 101.5° | 65.3° |
| H2 | C2 | C3 | N1 | 80.4° | 64.3° |
| H2 | C2 | C3 | H31 | 154.4° | 55.7° |
| H2 | C2 | C3 | H32 | 44.9° | 175.8° |
| H2 | C2 | N3 | S3 | 5.9° | 25.1° |
| H2 | C2 | N3 | HN3 | 131.2° | 155.0° |
| N1 | C3 | H31 | H32 | 119.0° | 120.0° |
| C3 | N1 | C4 | HN1 | 180.0° | 180.0° |
| C3 | N1 | C4 | O3 | 11.7° | 5.3° |
| C3 | N1 | C4 | C5 | 174.5° | 174.7° |
| H31 | C3 | N1 | C4 | 121.0° | 65.1° |
| H31 | C3 | N1 | HN1 | 59.1° | 114.9° |
| H32 | C3 | N1 | C4 | 11.5° | 54.9° |
| H32 | C3 | N1 | HN1 | 168.6° | 125.1° |
| N1 | C4 | O3 | C5 | 173.9° | 180.0° |
| N1 | C4 | C5 | C6 | 160.9° | 175.2° |
| N1 | C4 | C5 | S2 | 17.9° | 5.1° |
| HN1 | N1 | C4 | O3 | 168.3° | 174.7° |
| HN1 | N1 | C4 | C5 | 5.6° | 5.3° |
| O3 | C4 | C5 | C6 | 12.8° | 4.8° |
| O3 | C4 | C5 | S2 | 168.4° | 174.9° |
| C4 | C5 | C6 | S2 | 179.0° | 179.8° |
| C4 | C5 | C6 | C7 | 178.4° | 179.7° |
| C4 | C5 | C6 | H6 | 1.6° | 0.0° |
| C4 | C5 | S2 | C17 | 178.6° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 179.8° |
| C5 | C6 | C7 | C8 | 178.8° | 179.8° |
| C5 | C6 | C7 | C17 | 0.7° | 0.6° |
| C6 | C5 | S2 | C17 | 0.4° | 0.2° |
| S2 | C5 | C6 | C7 | 0.7° | 0.5° |
| S2 | C5 | C6 | H6 | 179.3° | 179.7° |
| C5 | S2 | C17 | C7 | 0.1° | 0.0° |
| C5 | S2 | C17 | S1 | 179.1° | 180.0° |
| C6 | C7 | C8 | C17 | 179.5° | 179.7° |
| C6 | C7 | C8 | C9 | 179.4° | 179.6° |
| C6 | C7 | C8 | H8 | 0.6° | 0.3° |
| C6 | C7 | C17 | S1 | 179.9° | 179.7° |
| C6 | C7 | C17 | S2 | 0.3° | 0.3° |
| H6 | C6 | C7 | C8 | 1.2° | 0.0° |
| H6 | C6 | C7 | C17 | 179.3° | 179.6° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 179.6° | 180.0° |
| C7 | C8 | C9 | S1 | 0.4° | 0.1° |
| C8 | C7 | C17 | S1 | 0.2° | 0.0° |
| C8 | C7 | C17 | S2 | 179.3° | 180.0° |
| C17 | C7 | C8 | C9 | 0.1° | 0.0° |
| C17 | C7 | C8 | H8 | 179.9° | 180.0° |
| C7 | C17 | S1 | C9 | 0.4° | 0.0° |
| C7 | C17 | S1 | S2 | 179.2° | 179.9° |
| C8 | C9 | C10 | S1 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 88.6° | 90.0° |
| C8 | C9 | C10 | H101 | 36.6° | 150.1° |
| C8 | C9 | C10 | H102 | 146.1° | 30.1° |
| C8 | C9 | S1 | C17 | 0.4° | 0.0° |
| H8 | C8 | C9 | C10 | 0.4° | 0.1° |
| H8 | C8 | C9 | S1 | 179.6° | 180.0° |
| C9 | C10 | C11 | H101 | 125.3° | 120.0° |
| C9 | C10 | C11 | H102 | 125.3° | 120.1° |
| C9 | C10 | H101 | H102 | 118.4° | 120.0° |
| C9 | C10 | C11 | C12 | 167.1° | 180.0° |
| C9 | C10 | C11 | H111 | 67.7° | 60.0° |
| C9 | C10 | C11 | H112 | 41.8° | 59.9° |
| C10 | C9 | S1 | C17 | 179.6° | 180.0° |
| S1 | C9 | C10 | C11 | 91.4° | 90.0° |
| S1 | C9 | C10 | H101 | 143.4° | 30.0° |
| S1 | C9 | C10 | H102 | 33.9° | 150.0° |
| C9 | S1 | C17 | S2 | 178.8° | 180.0° |
| C11 | C10 | H101 | H102 | 118.4° | 120.0° |
| C10 | C11 | C12 | H111 | 125.3° | 120.0° |
| C10 | C11 | C12 | H112 | 125.3° | 120.1° |
| C10 | C11 | H111 | H112 | 118.5° | 120.0° |
| C10 | C11 | C12 | C13 | 178.4° | 180.0° |
| C10 | C11 | C12 | C16 | 61.4° | 60.6° |
| C10 | C11 | C12 | H12 | 58.4° | 59.8° |
| H101 | C10 | C11 | C12 | 41.8° | 60.0° |
| H101 | C10 | C11 | H111 | 167.1° | 180.0° |
| H101 | C10 | C11 | H112 | 83.4° | 60.1° |
| H102 | C10 | C11 | C12 | 67.7° | 60.0° |
| H102 | C10 | C11 | H111 | 57.6° | 60.0° |
| H102 | C10 | C11 | H112 | 167.1° | 180.0° |
| C12 | C11 | H111 | H112 | 118.5° | 119.9° |
| C11 | C12 | C13 | C16 | 120.7° | 119.8° |
| C11 | C12 | C13 | H12 | 119.5° | 120.2° |
| C11 | C12 | C16 | H12 | 119.5° | 120.3° |
| C11 | C12 | C13 | C14 | 178.9° | 175.4° |
| C11 | C12 | C13 | H131 | 55.9° | 64.7° |
| C11 | C12 | C13 | H132 | 53.6° | 55.5° |
| C11 | C12 | C16 | C15 | 179.9° | 175.4° |
| C11 | C12 | C16 | H161 | 54.8° | 55.5° |
| C11 | C12 | C16 | H162 | 54.7° | 64.7° |
| H111 | C11 | C12 | C13 | 56.3° | 60.0° |
| H111 | C11 | C12 | C16 | 63.8° | 179.4° |
| H111 | C11 | C12 | H12 | 176.4° | 60.2° |
| H112 | C11 | C12 | C13 | 53.2° | 59.9° |
| H112 | C11 | C12 | C16 | 173.3° | 59.5° |
| H112 | C11 | C12 | H12 | 66.9° | 179.9° |
| C13 | C12 | C16 | H12 | 120.1° | 119.9° |
| C12 | C13 | C14 | H131 | 125.3° | 119.9° |
| C12 | C13 | C14 | H132 | 125.2° | 119.9° |
| C12 | C13 | H131 | H132 | 118.9° | 120.2° |
| C12 | C13 | C14 | N2 | 62.4° | 61.4° |
| C12 | C13 | C14 | H141 | 172.3° | 58.7° |
| C12 | C13 | C14 | H142 | 62.8° | 178.5° |
| C13 | C12 | C16 | C15 | 59.5° | 55.6° |
| C13 | C12 | C16 | H161 | 175.2° | 64.4° |
| C13 | C12 | C16 | H162 | 65.8° | 175.5° |
| C16 | C12 | C13 | C14 | 60.5° | 55.6° |
| C16 | C12 | C13 | H131 | 64.8° | 175.5° |
| C16 | C12 | C13 | H132 | 174.3° | 64.3° |
| C12 | C16 | C15 | N2 | 59.5° | 61.3° |
| C12 | C16 | C15 | H161 | 125.3° | 120.0° |
| C12 | C16 | C15 | H162 | 125.2° | 119.9° |
| C12 | C16 | C15 | H151 | 175.2° | 58.8° |
| C12 | C16 | C15 | H152 | 65.7° | 178.5° |
| C12 | C16 | H161 | H162 | 118.5° | 120.1° |
| H12 | C12 | C13 | C14 | 59.3° | 64.4° |
| H12 | C12 | C13 | H131 | 175.4° | 55.5° |
| H12 | C12 | C13 | H132 | 65.9° | 175.7° |
| H12 | C12 | C16 | C15 | 60.6° | 64.3° |
| H12 | C12 | C16 | H161 | 64.7° | 175.8° |
| H12 | C12 | C16 | H162 | 174.2° | 55.6° |
| C14 | C13 | H131 | H132 | 118.9° | 120.1° |
| C13 | C14 | N2 | H141 | 125.3° | 120.1° |
| C13 | C14 | N2 | H142 | 125.3° | 120.1° |
| C13 | C14 | H141 | H142 | 117.9° | 119.9° |
| C13 | C14 | N2 | C15 | 63.1° | 65.6° |
| C13 | C14 | N2 | HN2 | 62.2° | 179.7° |
| H131 | C13 | C14 | N2 | 62.8° | 178.7° |
| H131 | C13 | C14 | H141 | 62.4° | 61.2° |
| H131 | C13 | C14 | H142 | 171.9° | 58.6° |
| H132 | C13 | C14 | N2 | 172.3° | 58.6° |
| H132 | C13 | C14 | H141 | 47.1° | 178.6° |
| H132 | C13 | C14 | H142 | 62.4° | 61.5° |
| N2 | C14 | H141 | H142 | 117.9° | 119.8° |
| C14 | N2 | C15 | HN2 | 125.3° | 114.1° |
| C14 | N2 | C15 | C16 | 61.2° | 65.6° |
| C14 | N2 | C15 | H151 | 173.5° | 54.5° |
| C14 | N2 | C15 | H152 | 64.0° | 174.3° |
| H141 | C14 | N2 | C15 | 171.6° | 54.5° |
| H141 | C14 | N2 | HN2 | 63.1° | 59.6° |
| H142 | C14 | N2 | C15 | 62.2° | 174.3° |
| H142 | C14 | N2 | HN2 | 172.6° | 60.1° |
| N2 | C15 | C16 | H151 | 125.3° | 120.1° |
| N2 | C15 | C16 | H152 | 125.3° | 120.2° |
| N2 | C15 | H151 | H152 | 117.9° | 119.9° |
| N2 | C15 | C16 | H161 | 175.2° | 58.6° |
| N2 | C15 | C16 | H162 | 65.7° | 178.7° |
| HN2 | N2 | C15 | C16 | 64.0° | 179.7° |
| HN2 | N2 | C15 | H151 | 61.3° | 59.6° |
| HN2 | N2 | C15 | H152 | 170.7° | 60.2° |
| C16 | C15 | H151 | H152 | 117.9° | 119.8° |
| C15 | C16 | H161 | H162 | 118.5° | 120.1° |
| H151 | C15 | C16 | H161 | 49.9° | 178.7° |
| H151 | C15 | C16 | H162 | 59.6° | 61.2° |
| H152 | C15 | C16 | H161 | 59.5° | 61.6° |
| H152 | C15 | C16 | H162 | 169.0° | 58.5° |
| N3 | S3 | O4 | O5 | 118.7° | 123.1° |
| N3 | S3 | O4 | C18 | 118.4° | 113.8° |
| N3 | S3 | O5 | C18 | 116.2° | 113.7° |
| N3 | S3 | C18 | C19 | 80.7° | 94.5° |
| N3 | S3 | C18 | C22 | 100.1° | 85.8° |
| HN3 | N3 | S3 | O4 | 16.7° | 2.2° |
| HN3 | N3 | S3 | O5 | 113.6° | 132.6° |
| HN3 | N3 | S3 | C18 | 133.2° | 114.8° |
| O4 | S3 | O5 | C18 | 123.5° | 123.1° |
| O4 | S3 | C18 | C19 | 35.5° | 18.2° |
| O4 | S3 | C18 | C22 | 143.7° | 161.5° |
| O5 | S3 | C18 | C19 | 167.9° | 153.0° |
| O5 | S3 | C18 | C22 | 11.3° | 26.8° |
| S3 | C18 | C19 | C22 | 179.2° | 179.7° |
| S3 | C18 | C19 | C20 | 179.1° | 180.0° |
| S3 | C18 | C19 | H19 | 0.9° | 0.0° |
| S3 | C18 | C22 | N4 | 177.8° | 179.6° |
| S3 | C18 | C22 | H22 | 2.2° | 0.3° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 1.2° | 0.0° |
| C18 | C19 | C20 | H20 | 178.8° | 180.0° |
| C19 | C18 | C22 | N4 | 1.5° | 0.7° |
| C19 | C18 | C22 | H22 | 178.6° | 180.0° |
| C22 | C18 | C19 | C20 | 0.1° | 0.3° |
| C22 | C18 | C19 | H19 | 179.9° | 179.8° |
| C18 | C22 | N4 | C21 | 1.5° | 0.7° |
| C18 | C22 | N4 | H22 | 180.0° | 179.3° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | N4 | 1.2° | 0.0° |
| C19 | C20 | C21 | H21 | 178.7° | 180.0° |
| H19 | C19 | C20 | C21 | 178.8° | 179.9° |
| H19 | C19 | C20 | H20 | 1.1° | 0.0° |
| C20 | C21 | N4 | H21 | 180.0° | 180.0° |
| C20 | C21 | N4 | C22 | 0.1° | 0.4° |
| H20 | C20 | C21 | N4 | 178.8° | 179.9° |
| H20 | C20 | C21 | H21 | 1.2° | 0.0° |
| C21 | N4 | C22 | H22 | 178.6° | 180.0° |
| H21 | C21 | N4 | C22 | 179.9° | 179.7° |
