1YY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | O4 | sing | 1.43Å | 1.45Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| O4 | C20 | sing | 1.43Å | 1.45Å | |
| C18 | N3 | sing | 1.47Å | 1.47Å | |
| O2 | S1 | doub | 1.42Å | 1.49Å | |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C22 | C21 | sing | 1.53Å | 1.56Å | |
| C21 | N3 | sing | 1.47Å | 1.47Å | |
| N3 | C5 | sing | 1.47Å | 1.48Å | |
| C7 | C6 | doub | 1.33Å | 1.34Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.35Å | Aromatic |
| S1 | O1 | doub | 1.42Å | 1.49Å | |
| S1 | C6 | sing | 1.76Å | 1.74Å | |
| S1 | N1 | sing | 1.66Å | 1.61Å | |
| C6 | S2 | sing | 1.76Å | 1.67Å | Aromatic |
| C8 | C9 | doub | 1.33Å | 1.36Å | Aromatic |
| C5 | C3 | sing | 1.53Å | 1.54Å | |
| N1 | C2 | sing | 1.47Å | 1.48Å | |
| N1 | C1 | sing | 1.47Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.57Å | |
| C3 | N2 | sing | 1.47Å | 1.42Å | |
| C9 | S2 | sing | 1.76Å | 1.71Å | Aromatic |
| C1 | C4 | sing | 1.53Å | 1.54Å | |
| N2 | C4 | sing | 1.47Å | 1.44Å | |
| N2 | C10 | sing | 1.40Å | 1.39Å | |
| C11 | C10 | doub | 1.39Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.37Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.37Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C16 | sing | 1.51Å | 1.50Å | |
| O3 | C16 | sing | 1.43Å | 1.40Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | C23 | sing | 1.53Å | 1.50Å | |
| F1 | C23 | sing | 1.40Å | 1.30Å | |
| C23 | F2 | sing | 1.40Å | 1.35Å | |
| C23 | F3 | sing | 1.40Å | 1.36Å | |
| C22 | H1 | sing | 1.09Å | 1.10Å | |
| C22 | H2 | sing | 1.09Å | 1.10Å | |
| C22 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C18 | H9 | sing | 1.09Å | 1.10Å | |
| C18 | H10 | sing | 1.09Å | 1.10Å | |
| C5 | H12 | sing | 1.09Å | 1.10Å | |
| C5 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C2 | H16 | sing | 1.09Å | 1.10Å | |
| C7 | H17 | sing | 1.08Å | 1.08Å | |
| C8 | H18 | sing | 1.08Å | 1.08Å | |
| C9 | H19 | sing | 1.08Å | 1.08Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C4 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.08Å | 1.08Å | |
| C14 | H25 | sing | 1.08Å | 1.08Å | |
| C11 | H26 | sing | 1.08Å | 1.08Å | |
| C12 | H27 | sing | 1.08Å | 1.08Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C17 | H30 | sing | 1.09Å | 1.10Å | |
| O3 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C19 | C18 | 108.3° | 109.3° |
| C19 | O4 | C20 | 116.1° | 113.7° |
| O4 | C19 | H7 | 109.8° | 109.5° |
| O4 | C19 | H8 | 109.8° | 109.5° |
| C19 | C18 | N3 | 109.9° | 109.3° |
| C18 | C19 | H7 | 109.8° | 109.5° |
| C18 | C19 | H8 | 109.8° | 109.5° |
| C19 | C18 | H9 | 109.3° | 109.5° |
| C19 | C18 | H10 | 109.3° | 109.5° |
| O4 | C20 | C21 | 112.8° | 109.2° |
| O4 | C20 | H5 | 108.6° | 109.5° |
| O4 | C20 | H6 | 108.6° | 109.5° |
| C18 | N3 | C21 | 107.6° | 110.7° |
| C18 | N3 | C5 | 110.7° | 111.0° |
| N3 | C18 | H9 | 109.4° | 109.5° |
| N3 | C18 | H10 | 109.4° | 109.5° |
| O2 | S1 | O1 | 117.1° | 123.2° |
| O2 | S1 | C6 | 106.1° | 106.4° |
| O2 | S1 | N1 | 105.9° | 106.4° |
| C20 | C21 | C22 | 111.2° | 109.6° |
| C20 | C21 | N3 | 107.5° | 109.3° |
| C20 | C21 | H4 | 108.3° | 109.5° |
| C21 | C20 | H5 | 108.6° | 109.5° |
| C21 | C20 | H6 | 108.6° | 109.5° |
| C22 | C21 | N3 | 112.6° | 109.5° |
| C21 | C22 | H1 | 109.5° | 109.5° |
| C21 | C22 | H2 | 109.4° | 109.5° |
| C21 | C22 | H3 | 109.5° | 109.5° |
| C22 | C21 | H4 | 108.0° | 109.5° |
| C21 | N3 | C5 | 110.5° | 111.0° |
| N3 | C21 | H4 | 109.1° | 109.5° |
| N3 | C5 | C3 | 114.9° | 109.4° |
| N3 | C5 | H12 | 108.1° | 109.4° |
| N3 | C5 | H13 | 108.1° | 109.4° |
| C6 | C7 | C8 | 112.5° | 114.9° |
| C7 | C6 | S1 | 127.2° | 125.2° |
| C7 | C6 | S2 | 110.3° | 109.6° |
| C6 | C7 | H17 | 123.7° | 122.5° |
| C7 | C8 | C9 | 117.1° | 114.9° |
| C8 | C7 | H17 | 123.8° | 122.6° |
| C7 | C8 | H18 | 121.5° | 122.5° |
| O1 | S1 | C6 | 107.1° | 106.4° |
| O1 | S1 | N1 | 109.4° | 106.4° |
| C6 | S1 | N1 | 111.3° | 107.2° |
| S1 | C6 | S2 | 122.4° | 125.2° |
| S1 | N1 | C2 | 111.6° | 120.8° |
| S1 | N1 | C1 | 110.9° | 120.9° |
| C6 | S2 | C9 | 94.1° | 91.0° |
| C8 | C9 | S2 | 105.9° | 109.6° |
| C9 | C8 | H18 | 121.4° | 122.6° |
| C8 | C9 | H19 | 127.0° | 125.2° |
| C5 | C3 | C2 | 109.9° | 109.5° |
| C5 | C3 | N2 | 102.8° | 109.5° |
| C3 | C5 | H12 | 108.1° | 109.5° |
| C3 | C5 | H13 | 108.1° | 109.4° |
| C5 | C3 | H14 | 111.6° | 109.5° |
| C2 | N1 | C1 | 103.4° | 118.2° |
| N1 | C2 | C3 | 111.1° | 108.5° |
| N1 | C2 | H15 | 109.1° | 109.6° |
| N1 | C2 | H16 | 109.1° | 109.8° |
| N1 | C1 | C4 | 112.2° | 108.5° |
| N1 | C1 | H20 | 108.8° | 109.6° |
| N1 | C1 | H21 | 108.8° | 109.6° |
| C2 | C3 | N2 | 107.2° | 109.3° |
| C2 | C3 | H14 | 111.2° | 109.5° |
| C3 | C2 | H15 | 109.1° | 109.6° |
| C3 | C2 | H16 | 109.1° | 109.6° |
| C3 | N2 | C4 | 119.7° | 111.3° |
| C3 | N2 | C10 | 119.9° | 110.9° |
| N2 | C3 | H14 | 113.7° | 109.5° |
| S2 | C9 | H19 | 127.1° | 125.2° |
| C1 | C4 | N2 | 118.4° | 109.3° |
| C4 | C1 | H20 | 108.8° | 109.6° |
| C4 | C1 | H21 | 108.8° | 109.6° |
| C1 | C4 | H22 | 107.2° | 109.5° |
| C1 | C4 | H23 | 107.2° | 109.5° |
| C4 | N2 | C10 | 118.4° | 111.0° |
| N2 | C4 | H22 | 107.2° | 109.5° |
| N2 | C4 | H23 | 107.2° | 109.6° |
| N2 | C10 | C11 | 122.3° | 120.1° |
| N2 | C10 | C15 | 119.9° | 120.0° |
| C10 | C11 | C12 | 122.1° | 120.0° |
| C11 | C10 | C15 | 117.8° | 119.8° |
| C10 | C11 | H26 | 119.0° | 120.0° |
| C11 | C12 | C13 | 119.1° | 120.0° |
| C12 | C11 | H26 | 119.0° | 120.0° |
| C11 | C12 | H27 | 120.4° | 120.0° |
| C10 | C15 | C14 | 121.6° | 119.9° |
| C10 | C15 | H24 | 119.2° | 120.0° |
| C12 | C13 | C14 | 120.2° | 120.2° |
| C12 | C13 | C16 | 120.8° | 119.9° |
| C13 | C12 | H27 | 120.4° | 120.0° |
| C15 | C14 | C13 | 119.2° | 120.1° |
| C14 | C15 | H24 | 119.2° | 120.1° |
| C15 | C14 | H25 | 120.4° | 120.0° |
| C14 | C13 | C16 | 119.0° | 119.9° |
| C13 | C14 | H25 | 120.4° | 119.9° |
| C13 | C16 | O3 | 108.7° | 109.5° |
| C13 | C16 | C17 | 104.3° | 109.5° |
| C13 | C16 | C23 | 114.5° | 109.4° |
| O3 | C16 | C17 | 112.7° | 109.5° |
| O3 | C16 | C23 | 109.7° | 109.5° |
| C16 | O3 | H31 | 109.5° | 114.0° |
| C17 | C16 | C23 | 106.8° | 109.4° |
| C16 | C17 | H28 | 109.5° | 109.5° |
| C16 | C17 | H29 | 109.5° | 109.4° |
| C16 | C17 | H30 | 109.5° | 109.5° |
| C16 | C23 | F1 | 106.3° | 109.5° |
| C16 | C23 | F2 | 110.4° | 109.5° |
| C16 | C23 | F3 | 108.2° | 109.5° |
| F1 | C23 | F2 | 106.8° | 109.5° |
| F1 | C23 | F3 | 114.6° | 109.5° |
| F2 | C23 | F3 | 110.5° | 109.5° |
| H1 | C22 | H2 | 109.5° | 109.5° |
| H1 | C22 | H3 | 109.5° | 109.4° |
| H2 | C22 | H3 | 109.4° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.6° |
| H7 | C19 | H8 | 109.4° | 109.6° |
| H9 | C18 | H10 | 109.5° | 109.6° |
| H12 | C5 | H13 | 109.4° | 109.5° |
| H15 | C2 | H16 | 109.5° | 109.6° |
| H20 | C1 | H21 | 109.4° | 109.9° |
| H22 | C4 | H23 | 109.5° | 109.5° |
| H28 | C17 | H29 | 109.5° | 109.5° |
| H28 | C17 | H30 | 109.5° | 109.5° |
| H29 | C17 | H30 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C19 | C18 | H7 | 119.9° | 119.9° |
| O4 | C19 | C18 | H8 | 119.8° | 119.9° |
| O4 | C19 | C18 | N3 | 57.8° | 56.9° |
| C19 | O4 | C20 | C21 | 48.7° | 58.7° |
| C19 | O4 | C20 | H5 | 169.2° | 61.2° |
| C19 | O4 | C20 | H6 | 71.8° | 178.6° |
| O4 | C19 | H7 | H8 | 120.5° | 120.1° |
| O4 | C19 | C18 | H9 | 177.9° | 176.8° |
| O4 | C19 | C18 | H10 | 62.3° | 63.0° |
| C18 | C19 | O4 | C20 | 48.7° | 58.7° |
| C19 | C18 | N3 | H9 | 120.1° | 119.9° |
| C19 | C18 | N3 | H10 | 120.1° | 119.9° |
| C19 | C18 | N3 | C21 | 67.6° | 58.6° |
| C19 | C18 | N3 | C5 | 171.6° | 177.6° |
| C18 | C19 | H7 | H8 | 120.5° | 120.1° |
| C19 | C18 | H9 | H10 | 119.8° | 120.1° |
| O4 | C20 | C21 | H5 | 120.5° | 119.9° |
| O4 | C20 | C21 | H6 | 120.5° | 119.9° |
| O4 | C20 | C21 | C22 | 69.6° | 63.1° |
| O4 | C20 | C21 | N3 | 54.2° | 56.9° |
| O4 | C20 | C21 | H4 | 172.0° | 176.8° |
| O4 | C20 | H5 | H6 | 118.5° | 120.1° |
| C20 | O4 | C19 | H7 | 71.2° | 61.2° |
| C20 | O4 | C19 | H8 | 168.5° | 178.6° |
| C18 | N3 | C21 | C20 | 63.7° | 58.6° |
| C18 | N3 | C21 | C22 | 59.2° | 61.4° |
| C18 | N3 | C21 | C5 | 120.9° | 123.8° |
| C18 | N3 | C5 | C3 | 100.0° | 117.2° |
| C18 | N3 | C21 | H4 | 179.1° | 178.5° |
| N3 | C18 | C19 | H7 | 62.1° | 63.1° |
| N3 | C18 | C19 | H8 | 177.6° | 176.7° |
| N3 | C18 | H9 | H10 | 119.8° | 120.1° |
| C18 | N3 | C5 | H12 | 20.9° | 2.9° |
| C18 | N3 | C5 | H13 | 139.2° | 122.9° |
| O2 | S1 | C6 | C7 | 19.4° | 174.4° |
| O2 | S1 | O1 | C6 | 118.9° | 123.0° |
| O2 | S1 | O1 | N1 | 120.4° | 123.0° |
| O2 | S1 | C6 | N1 | 114.7° | 113.6° |
| O2 | S1 | C6 | S2 | 161.1° | 5.9° |
| O2 | S1 | N1 | C2 | 70.5° | 12.2° |
| O2 | S1 | N1 | C1 | 174.8° | 167.8° |
| C20 | C21 | C22 | N3 | 120.8° | 119.8° |
| C20 | C21 | C22 | H4 | 118.7° | 120.1° |
| C20 | C21 | N3 | H4 | 117.3° | 119.9° |
| C20 | C21 | N3 | C5 | 175.4° | 177.6° |
| C20 | C21 | C22 | H1 | 180.0° | 68.0° |
| C20 | C21 | C22 | H2 | 60.0° | 52.0° |
| C20 | C21 | C22 | H3 | 60.0° | 172.0° |
| C21 | C20 | H5 | H6 | 118.5° | 120.1° |
| C22 | C21 | N3 | H4 | 119.9° | 120.1° |
| C22 | C21 | N3 | C5 | 61.7° | 62.4° |
| C21 | C22 | H1 | H2 | 120.0° | 120.0° |
| C21 | C22 | H1 | H3 | 120.0° | 120.0° |
| C21 | C22 | H2 | H3 | 120.0° | 120.1° |
| C22 | C21 | C20 | H5 | 50.9° | 177.0° |
| C22 | C21 | C20 | H6 | 169.9° | 56.8° |
| C21 | N3 | C5 | C3 | 140.9° | 119.2° |
| N3 | C21 | C22 | H1 | 59.2° | 51.8° |
| N3 | C21 | C22 | H2 | 60.8° | 171.8° |
| N3 | C21 | C22 | H3 | 179.2° | 68.2° |
| N3 | C21 | C20 | H5 | 174.7° | 63.0° |
| N3 | C21 | C20 | H6 | 66.3° | 176.8° |
| C21 | N3 | C18 | H9 | 172.3° | 178.5° |
| C21 | N3 | C18 | H10 | 52.5° | 61.3° |
| C21 | N3 | C5 | H12 | 98.3° | 120.8° |
| C21 | N3 | C5 | H13 | 20.1° | 0.7° |
| N3 | C5 | C3 | H12 | 120.8° | 120.0° |
| N3 | C5 | C3 | H13 | 120.8° | 119.9° |
| N3 | C5 | C3 | C2 | 103.7° | 90.3° |
| N3 | C5 | C3 | N2 | 142.4° | 149.9° |
| C5 | N3 | C21 | H4 | 58.1° | 57.7° |
| C5 | N3 | C18 | H9 | 51.5° | 57.7° |
| C5 | N3 | C18 | H10 | 68.3° | 62.5° |
| N3 | C5 | H12 | H13 | 117.5° | 120.0° |
| N3 | C5 | C3 | H14 | 20.2° | 29.7° |
| C6 | C7 | C8 | H17 | 180.0° | 180.0° |
| C7 | C6 | S1 | O1 | 145.2° | 52.6° |
| C7 | C6 | S1 | S2 | 179.5° | 179.7° |
| C7 | C6 | S1 | N1 | 95.3° | 60.8° |
| C6 | C7 | C8 | C9 | 1.0° | 0.0° |
| C7 | C6 | S2 | C9 | 2.2° | 0.3° |
| C6 | C7 | C8 | H18 | 179.0° | 179.9° |
| C8 | C7 | C6 | S1 | 177.4° | 180.0° |
| C8 | C7 | C6 | S2 | 2.2° | 0.3° |
| C7 | C8 | C9 | H18 | 180.0° | 179.9° |
| C7 | C8 | C9 | S2 | 0.6° | 0.3° |
| C7 | C8 | C9 | H19 | 179.4° | 180.0° |
| O1 | S1 | C6 | N1 | 119.5° | 113.5° |
| O1 | S1 | C6 | S2 | 35.3° | 127.0° |
| O1 | S1 | N1 | C2 | 162.4° | 145.2° |
| O1 | S1 | N1 | C1 | 47.7° | 34.9° |
| C6 | S1 | N1 | C2 | 44.3° | 101.3° |
| C6 | S1 | N1 | C1 | 70.4° | 78.6° |
| S1 | C6 | S2 | C9 | 177.4° | 179.9° |
| S1 | C6 | C7 | H17 | 2.6° | 0.1° |
| N1 | S1 | C6 | S2 | 84.2° | 119.5° |
| S1 | N1 | C2 | C1 | 119.2° | 180.0° |
| S1 | N1 | C2 | C3 | 167.7° | 128.8° |
| S1 | N1 | C1 | C4 | 176.8° | 128.8° |
| S1 | N1 | C2 | H15 | 47.5° | 111.5° |
| S1 | N1 | C2 | H16 | 72.0° | 9.0° |
| S1 | N1 | C1 | H20 | 56.3° | 111.5° |
| S1 | N1 | C1 | H21 | 62.8° | 9.1° |
| C6 | S2 | C9 | C8 | 1.6° | 0.3° |
| S2 | C6 | C7 | H17 | 177.8° | 179.8° |
| C6 | S2 | C9 | H19 | 178.4° | 179.9° |
| C8 | C9 | S2 | H19 | 180.0° | 179.7° |
| C9 | C8 | C7 | H17 | 179.0° | 180.0° |
| C5 | C3 | C2 | N1 | 49.8° | 66.1° |
| C5 | C3 | C2 | N2 | 111.0° | 119.9° |
| C5 | C3 | C2 | H14 | 124.1° | 120.1° |
| C5 | C3 | N2 | H14 | 120.8° | 120.1° |
| C5 | C3 | N2 | C4 | 80.9° | 56.8° |
| C5 | C3 | N2 | C10 | 82.7° | 67.3° |
| C3 | C5 | H12 | H13 | 117.5° | 120.0° |
| C5 | C3 | C2 | H15 | 70.5° | 174.2° |
| C5 | C3 | C2 | H16 | 170.0° | 53.8° |
| N1 | C2 | C3 | H15 | 120.2° | 119.7° |
| N1 | C2 | C3 | H16 | 120.3° | 119.9° |
| N1 | C2 | C3 | N2 | 61.2° | 53.8° |
| C2 | N1 | C1 | C4 | 57.0° | 51.2° |
| N1 | C2 | C3 | H14 | 173.9° | 173.8° |
| N1 | C2 | H15 | H16 | 119.3° | 120.6° |
| C2 | N1 | C1 | H20 | 63.4° | 68.5° |
| C2 | N1 | C1 | H21 | 177.4° | 170.9° |
| C1 | N1 | C2 | C3 | 73.0° | 51.2° |
| N1 | C1 | C4 | H20 | 120.4° | 119.7° |
| N1 | C1 | C4 | H21 | 120.4° | 119.7° |
| N1 | C1 | C4 | N2 | 35.6° | 53.9° |
| C1 | N1 | C2 | H15 | 166.7° | 68.5° |
| C1 | N1 | C2 | H16 | 47.2° | 171.0° |
| N1 | C1 | H20 | H21 | 118.7° | 120.5° |
| N1 | C1 | C4 | H22 | 156.9° | 173.8° |
| N1 | C1 | C4 | H23 | 85.7° | 66.1° |
| C2 | C3 | N2 | H14 | 123.4° | 120.0° |
| C2 | C3 | N2 | C4 | 34.9° | 63.1° |
| C2 | C3 | N2 | C10 | 161.5° | 172.7° |
| C2 | C3 | C5 | H12 | 17.2° | 29.7° |
| C2 | C3 | C5 | H13 | 135.5° | 149.8° |
| C3 | C2 | H15 | H16 | 119.2° | 120.4° |
| C3 | N2 | C4 | C1 | 24.5° | 63.2° |
| C3 | N2 | C4 | C10 | 163.8° | 124.1° |
| C3 | N2 | C10 | C11 | 2.2° | 57.9° |
| C3 | N2 | C10 | C15 | 178.2° | 121.9° |
| N2 | C3 | C5 | H12 | 96.7° | 90.2° |
| N2 | C3 | C5 | H13 | 21.6° | 29.9° |
| N2 | C3 | C2 | H15 | 178.5° | 65.9° |
| N2 | C3 | C2 | H16 | 59.0° | 173.7° |
| C3 | N2 | C4 | H22 | 145.8° | 176.9° |
| C3 | N2 | C4 | H23 | 96.8° | 56.8° |
| S2 | C9 | C8 | H18 | 179.4° | 179.8° |
| C1 | C4 | N2 | H22 | 121.3° | 119.9° |
| C1 | C4 | N2 | H23 | 121.3° | 120.0° |
| C1 | C4 | N2 | C10 | 171.7° | 172.8° |
| C4 | C1 | H20 | H21 | 118.8° | 120.5° |
| C1 | C4 | H22 | H23 | 115.9° | 120.0° |
| C4 | N2 | C10 | C11 | 165.9° | 177.9° |
| C4 | N2 | C10 | C15 | 14.5° | 2.4° |
| C4 | N2 | C3 | H14 | 158.3° | 176.9° |
| N2 | C4 | C1 | H20 | 84.8° | 65.8° |
| N2 | C4 | C1 | H21 | 156.0° | 173.5° |
| N2 | C4 | H22 | H23 | 115.9° | 120.1° |
| N2 | C10 | C11 | C15 | 179.6° | 179.8° |
| N2 | C10 | C11 | C12 | 179.7° | 180.0° |
| N2 | C10 | C15 | C14 | 180.0° | 180.0° |
| C10 | N2 | C3 | H14 | 38.1° | 52.8° |
| C10 | N2 | C4 | H22 | 50.4° | 52.8° |
| C10 | N2 | C4 | H23 | 67.0° | 67.3° |
| N2 | C10 | C15 | H24 | 0.0° | 0.0° |
| N2 | C10 | C11 | H26 | 0.3° | 0.0° |
| C10 | C11 | C12 | H26 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 0.8° | 0.0° |
| C11 | C10 | C15 | C14 | 0.4° | 0.2° |
| C11 | C10 | C15 | H24 | 179.6° | 179.7° |
| C10 | C11 | C12 | H27 | 179.2° | 180.0° |
| C12 | C11 | C10 | C15 | 0.7° | 0.3° |
| C11 | C12 | C13 | H27 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.5° | 0.3° |
| C11 | C12 | C13 | C16 | 178.8° | 180.0° |
| C10 | C15 | C14 | H24 | 180.0° | 180.0° |
| C10 | C15 | C14 | C13 | 0.2° | 0.1° |
| C10 | C15 | C14 | H25 | 179.8° | 180.0° |
| C15 | C10 | C11 | H26 | 179.3° | 179.7° |
| C12 | C13 | C14 | C15 | 0.2° | 0.3° |
| C12 | C13 | C14 | C16 | 178.3° | 179.7° |
| C12 | C13 | C16 | O3 | 17.9° | 30.0° |
| C12 | C13 | C16 | C17 | 138.4° | 150.0° |
| C12 | C13 | C16 | C23 | 105.2° | 90.0° |
| C12 | C13 | C14 | H25 | 179.7° | 179.7° |
| C13 | C12 | C11 | H26 | 179.3° | 180.0° |
| C15 | C14 | C13 | H25 | 180.0° | 179.9° |
| C15 | C14 | C13 | C16 | 178.6° | 180.0° |
| C14 | C13 | C16 | O3 | 160.4° | 149.7° |
| C14 | C13 | C16 | C17 | 39.9° | 29.6° |
| C14 | C13 | C16 | C23 | 76.5° | 90.3° |
| C13 | C14 | C15 | H24 | 179.8° | 180.0° |
| C14 | C13 | C12 | H27 | 179.5° | 179.7° |
| C13 | C16 | O3 | C17 | 115.2° | 120.0° |
| C13 | C16 | O3 | C23 | 126.0° | 120.0° |
| C13 | C16 | C17 | C23 | 121.6° | 119.9° |
| C13 | C16 | C23 | F1 | 55.3° | 60.0° |
| C13 | C16 | C23 | F2 | 170.8° | 60.0° |
| C13 | C16 | C23 | F3 | 68.2° | 180.0° |
| C16 | C13 | C14 | H25 | 1.4° | 0.1° |
| C16 | C13 | C12 | H27 | 1.2° | 0.0° |
| C13 | C16 | C17 | H28 | 180.0° | 60.0° |
| C13 | C16 | C17 | H29 | 60.0° | 180.0° |
| C13 | C16 | C17 | H30 | 60.0° | 60.0° |
| C13 | C16 | O3 | H31 | 180.0° | 59.9° |
| O3 | C16 | C17 | C23 | 120.6° | 120.0° |
| O3 | C16 | C23 | F1 | 67.3° | 60.0° |
| O3 | C16 | C23 | F2 | 48.2° | 180.0° |
| O3 | C16 | C23 | F3 | 169.3° | 60.0° |
| O3 | C16 | C17 | H28 | 62.2° | 60.0° |
| O3 | C16 | C17 | H29 | 177.8° | 60.0° |
| O3 | C16 | C17 | H30 | 57.8° | 179.9° |
| C17 | C16 | C23 | F1 | 170.2° | 180.0° |
| C17 | C16 | C23 | F2 | 74.3° | 60.0° |
| C17 | C16 | C23 | F3 | 46.8° | 60.0° |
| C16 | C17 | H28 | H29 | 120.0° | 120.0° |
| C16 | C17 | H28 | H30 | 120.0° | 120.0° |
| C16 | C17 | H29 | H30 | 120.0° | 120.0° |
| C17 | C16 | O3 | H31 | 64.8° | 180.0° |
| C16 | C23 | F1 | F2 | 117.8° | 120.0° |
| C16 | C23 | F1 | F3 | 119.4° | 120.0° |
| C16 | C23 | F2 | F3 | 119.6° | 120.0° |
| C23 | C16 | C17 | H28 | 58.4° | 180.0° |
| C23 | C16 | C17 | H29 | 61.6° | 60.0° |
| C23 | C16 | C17 | H30 | 178.4° | 60.0° |
| C23 | C16 | O3 | H31 | 54.0° | 60.1° |
| F1 | C23 | F2 | F3 | 125.2° | 120.0° |
| H1 | C22 | H2 | H3 | 120.0° | 120.0° |
| H1 | C22 | C21 | H4 | 61.3° | 171.9° |
| H2 | C22 | C21 | H4 | 178.7° | 68.2° |
| H3 | C22 | C21 | H4 | 58.7° | 51.9° |
| H4 | C21 | C20 | H5 | 67.5° | 56.8° |
| H4 | C21 | C20 | H6 | 51.5° | 63.3° |
| H7 | C19 | C18 | H9 | 58.0° | 56.8° |
| H7 | C19 | C18 | H10 | 177.9° | 177.0° |
| H8 | C19 | C18 | H9 | 62.3° | 63.4° |
| H8 | C19 | C18 | H10 | 57.5° | 56.8° |
| H12 | C5 | C3 | H14 | 141.0° | 149.7° |
| H13 | C5 | C3 | H14 | 100.6° | 90.2° |
| H14 | C3 | C2 | H15 | 53.6° | 54.1° |
| H14 | C3 | C2 | H16 | 65.9° | 66.3° |
| H17 | C7 | C8 | H18 | 1.0° | 0.0° |
| H18 | C8 | C9 | H19 | 0.6° | 0.1° |
| H20 | C1 | C4 | H22 | 36.5° | 54.1° |
| H20 | C1 | C4 | H23 | 153.9° | 174.2° |
| H21 | C1 | C4 | H22 | 82.7° | 66.6° |
| H21 | C1 | C4 | H23 | 34.7° | 53.5° |
| H24 | C15 | C14 | H25 | 0.2° | 0.0° |
| H26 | C11 | C12 | H27 | 0.8° | 0.0° |
| H28 | C17 | H29 | H30 | 120.0° | 120.0° |
