UV2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C6 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| S1 | C17 | sing | 1.76Å | 1.76Å | |
| S1 | C16 | sing | 1.81Å | 1.81Å | |
| C17 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.50Å | |
| N1 | C2 | sing | 1.46Å | 1.45Å | |
| N1 | C1 | sing | 1.35Å | 1.34Å | |
| O5 | C15 | sing | 1.45Å | 1.45Å | |
| O5 | C1 | sing | 1.35Å | 1.34Å | |
| C2 | C7 | sing | 1.51Å | 1.53Å | |
| C1 | O1 | doub | 1.22Å | 1.21Å | |
| C7 | O4 | doub | 1.21Å | 1.23Å | |
| C7 | N2 | sing | 1.35Å | 1.34Å | |
| N2 | C8 | sing | 1.47Å | 1.46Å | |
| O3 | C14 | sing | 1.43Å | 1.42Å | |
| S2 | C14 | sing | 1.81Å | 1.80Å | |
| C8 | C14 | sing | 1.53Å | 1.52Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C10 | C13 | sing | 1.55Å | 1.52Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| C13 | C12 | sing | 1.54Å | 1.52Å | |
| C12 | N3 | sing | 1.47Å | 1.46Å | |
| C11 | O2 | doub | 1.21Å | 1.24Å | |
| C11 | N3 | sing | 1.34Å | 1.33Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| N2 | H3 | sing | 0.97Å | 1.00Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| N3 | H12 | sing | 0.97Å | 1.00Å | |
| C4 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| C3 | H15 | sing | 1.09Å | 1.10Å | |
| O3 | H16 | sing | 0.97Å | 0.95Å | |
| C2 | H17 | sing | 1.09Å | 1.10Å | |
| C10 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.08Å | 1.08Å | |
| C19 | H29 | sing | 1.08Å | 1.08Å | |
| C20 | H30 | sing | 1.08Å | 1.08Å | |
| C21 | H31 | sing | 1.08Å | 1.08Å | |
| C22 | H32 | sing | 1.08Å | 1.08Å | |
| S2 | O6 | sing | 1.52Å | 1.81Å | |
| S2 | O7 | doub | 1.42Å | 35.08Å | |
| S2 | O8 | doub | 1.42Å | 35.08Å | |
| O6 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C6 | 110.4° | 109.5° |
| C5 | C4 | C3 | 111.0° | 109.5° |
| C4 | C5 | H6 | 109.5° | 109.5° |
| C4 | C5 | H7 | 109.5° | 109.5° |
| C4 | C5 | H8 | 109.5° | 109.5° |
| C5 | C4 | H13 | 108.2° | 109.4° |
| C19 | C18 | C17 | 120.0° | 119.9° |
| C18 | C19 | C20 | 120.4° | 120.0° |
| C19 | C18 | H28 | 120.0° | 120.1° |
| C18 | C19 | H29 | 119.8° | 120.0° |
| C18 | C17 | S1 | 120.6° | 120.1° |
| C18 | C17 | C22 | 119.2° | 119.8° |
| C17 | C18 | H28 | 120.0° | 120.0° |
| C6 | C4 | C3 | 110.7° | 109.5° |
| C4 | C6 | H9 | 109.5° | 109.5° |
| C4 | C6 | H10 | 109.5° | 109.5° |
| C4 | C6 | H11 | 109.5° | 109.5° |
| C6 | C4 | H13 | 108.2° | 109.5° |
| C4 | C3 | C2 | 114.7° | 109.5° |
| C3 | C4 | H13 | 108.2° | 109.5° |
| C4 | C3 | H14 | 108.2° | 109.5° |
| C4 | C3 | H15 | 108.1° | 109.4° |
| C19 | C20 | C21 | 120.0° | 120.2° |
| C20 | C19 | H29 | 119.8° | 120.0° |
| C19 | C20 | H30 | 120.0° | 119.9° |
| C17 | S1 | C16 | 103.5° | 103.0° |
| S1 | C17 | C22 | 120.3° | 120.1° |
| S1 | C16 | C15 | 112.7° | 109.5° |
| S1 | C16 | H26 | 108.7° | 109.5° |
| S1 | C16 | H27 | 108.7° | 109.5° |
| C17 | C22 | C21 | 120.1° | 119.9° |
| C17 | C22 | H32 | 119.9° | 120.1° |
| C20 | C21 | C22 | 120.4° | 120.1° |
| C21 | C20 | H30 | 120.0° | 119.9° |
| C20 | C21 | H31 | 119.8° | 119.9° |
| C22 | C21 | H31 | 119.8° | 120.0° |
| C21 | C22 | H32 | 120.0° | 120.0° |
| C3 | C2 | N1 | 109.6° | 109.5° |
| C3 | C2 | C7 | 110.7° | 109.5° |
| C2 | C3 | H14 | 108.1° | 109.5° |
| C2 | C3 | H15 | 108.2° | 109.4° |
| C3 | C2 | H17 | 107.7° | 109.4° |
| C16 | C15 | O5 | 105.9° | 109.5° |
| C16 | C15 | H24 | 110.4° | 109.4° |
| C16 | C15 | H25 | 110.4° | 109.5° |
| C15 | C16 | H26 | 108.6° | 109.4° |
| C15 | C16 | H27 | 108.7° | 109.5° |
| C2 | N1 | C1 | 121.0° | 120.0° |
| N1 | C2 | C7 | 112.5° | 109.5° |
| C2 | N1 | H1 | 119.5° | 120.1° |
| N1 | C2 | H17 | 108.6° | 109.5° |
| N1 | C1 | O5 | 109.7° | 120.0° |
| N1 | C1 | O1 | 124.8° | 120.0° |
| C1 | N1 | H1 | 119.5° | 120.0° |
| C15 | O5 | C1 | 116.6° | 117.0° |
| O5 | C15 | H24 | 110.3° | 109.5° |
| O5 | C15 | H25 | 110.3° | 109.5° |
| O5 | C1 | O1 | 125.5° | 120.0° |
| C2 | C7 | O4 | 120.6° | 120.0° |
| C2 | C7 | N2 | 116.8° | 120.0° |
| C7 | C2 | H17 | 107.6° | 109.5° |
| O4 | C7 | N2 | 122.6° | 120.0° |
| C7 | N2 | C8 | 123.1° | 120.0° |
| C7 | N2 | H3 | 118.5° | 120.0° |
| N2 | C8 | C14 | 110.9° | 109.5° |
| N2 | C8 | C9 | 110.4° | 109.5° |
| N2 | C8 | H2 | 108.6° | 109.5° |
| C8 | N2 | H3 | 118.5° | 120.0° |
| O3 | C14 | S2 | 108.8° | 109.5° |
| O3 | C14 | C8 | 109.8° | 109.5° |
| C14 | O3 | H16 | 109.5° | 114.1° |
| O3 | C14 | H23 | 111.7° | 109.4° |
| S2 | C14 | C8 | 109.4° | 109.5° |
| S2 | C14 | H23 | 106.9° | 109.5° |
| C14 | S2 | O6 | 103.0° | 104.4° |
| C14 | S2 | O7 | 117.7° | 110.5° |
| C14 | S2 | O8 | 117.7° | 110.6° |
| C14 | C8 | C9 | 111.3° | 109.4° |
| C14 | C8 | H2 | 107.9° | 109.4° |
| C8 | C14 | H23 | 110.1° | 109.5° |
| C8 | C9 | C10 | 112.7° | 109.5° |
| C9 | C8 | H2 | 107.8° | 109.5° |
| C8 | C9 | H4 | 108.7° | 109.5° |
| C8 | C9 | H5 | 108.7° | 109.5° |
| C9 | C10 | C13 | 115.6° | 110.5° |
| C9 | C10 | C11 | 113.6° | 110.5° |
| C10 | C9 | H4 | 108.7° | 109.4° |
| C10 | C9 | H5 | 108.7° | 109.5° |
| C9 | C10 | H18 | 108.2° | 110.5° |
| C13 | C10 | C11 | 102.7° | 104.2° |
| C10 | C13 | C12 | 103.5° | 101.7° |
| C13 | C10 | H18 | 108.2° | 110.4° |
| C10 | C13 | H19 | 111.0° | 110.9° |
| C10 | C13 | H20 | 110.9° | 110.9° |
| C10 | C11 | O2 | 125.5° | 124.9° |
| C10 | C11 | N3 | 108.6° | 110.1° |
| C11 | C10 | H18 | 108.3° | 110.6° |
| C13 | C12 | N3 | 102.2° | 105.4° |
| C12 | C13 | H19 | 111.0° | 111.0° |
| C12 | C13 | H20 | 110.9° | 111.0° |
| C13 | C12 | H21 | 111.3° | 110.3° |
| C13 | C12 | H22 | 111.3° | 110.2° |
| C12 | N3 | C11 | 113.1° | 111.3° |
| C12 | N3 | H12 | 123.5° | 124.3° |
| N3 | C12 | H21 | 111.3° | 110.3° |
| N3 | C12 | H22 | 111.2° | 110.1° |
| O2 | C11 | N3 | 125.9° | 124.9° |
| C11 | N3 | H12 | 123.5° | 124.3° |
| H4 | C9 | H5 | 109.4° | 109.5° |
| H6 | C5 | H7 | 109.4° | 109.5° |
| H6 | C5 | H8 | 109.4° | 109.4° |
| H7 | C5 | H8 | 109.5° | 109.4° |
| H9 | C6 | H10 | 109.4° | 109.4° |
| H9 | C6 | H11 | 109.4° | 109.5° |
| H10 | C6 | H11 | 109.5° | 109.5° |
| H14 | C3 | H15 | 109.5° | 109.5° |
| H19 | C13 | H20 | 109.5° | 110.9° |
| H21 | C12 | H22 | 109.5° | 110.3° |
| H24 | C15 | H25 | 109.5° | 109.5° |
| H26 | C16 | H27 | 109.5° | 109.5° |
| O6 | S2 | O7 | 138.1° | 104.2° |
| O6 | S2 | O8 | 138.1° | 104.3° |
| S2 | O6 | H33 | 109.5° | 114.0° |
| O7 | S2 | O8 | 0.0° | 121.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C6 | C3 | 123.3° | 120.0° |
| C5 | C4 | C6 | H13 | 118.3° | 120.0° |
| C5 | C4 | C3 | H13 | 118.6° | 120.0° |
| C5 | C4 | C3 | C2 | 174.5° | 175.0° |
| C4 | C5 | H6 | H7 | 120.0° | 120.1° |
| C4 | C5 | H6 | H8 | 120.0° | 120.0° |
| C4 | C5 | H7 | H8 | 120.0° | 120.0° |
| C5 | C4 | C6 | H9 | 180.0° | 179.9° |
| C5 | C4 | C6 | H10 | 60.0° | 60.0° |
| C5 | C4 | C6 | H11 | 60.0° | 60.0° |
| C5 | C4 | C3 | H14 | 64.7° | 65.0° |
| C5 | C4 | C3 | H15 | 53.8° | 55.0° |
| C19 | C18 | C17 | H28 | 180.0° | 179.9° |
| C18 | C19 | C20 | H29 | 180.0° | 180.0° |
| C19 | C18 | C17 | S1 | 179.7° | 179.7° |
| C19 | C18 | C17 | C22 | 0.1° | 0.1° |
| C18 | C19 | C20 | C21 | 0.0° | 0.0° |
| C18 | C19 | C20 | H30 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.0° | 0.0° |
| C18 | C17 | S1 | C22 | 179.7° | 179.6° |
| C18 | C17 | S1 | C16 | 114.5° | 0.3° |
| C18 | C17 | C22 | C21 | 0.1° | 0.1° |
| C17 | C18 | C19 | H29 | 180.0° | 180.0° |
| C18 | C17 | C22 | H32 | 179.9° | 180.0° |
| C6 | C4 | C3 | H13 | 118.4° | 120.0° |
| C6 | C4 | C3 | C2 | 62.5° | 65.1° |
| C6 | C4 | C5 | H6 | 180.0° | 60.0° |
| C6 | C4 | C5 | H7 | 60.0° | 180.0° |
| C6 | C4 | C5 | H8 | 60.0° | 60.0° |
| C4 | C6 | H9 | H10 | 120.0° | 120.0° |
| C4 | C6 | H9 | H11 | 120.0° | 120.1° |
| C4 | C6 | H10 | H11 | 120.0° | 120.0° |
| C6 | C4 | C3 | H14 | 58.3° | 55.0° |
| C6 | C4 | C3 | H15 | 176.8° | 175.0° |
| C4 | C3 | C2 | H14 | 120.8° | 120.0° |
| C4 | C3 | C2 | H15 | 120.7° | 119.9° |
| C4 | C3 | C2 | N1 | 59.3° | 65.0° |
| C4 | C3 | C2 | C7 | 176.1° | 175.0° |
| C3 | C4 | C5 | H6 | 56.9° | 180.0° |
| C3 | C4 | C5 | H7 | 63.1° | 60.0° |
| C3 | C4 | C5 | H8 | 176.8° | 60.0° |
| C3 | C4 | C6 | H9 | 56.7° | 60.1° |
| C3 | C4 | C6 | H10 | 176.7° | 180.0° |
| C3 | C4 | C6 | H11 | 63.3° | 60.0° |
| C4 | C3 | H14 | H15 | 117.6° | 120.0° |
| C4 | C3 | C2 | H17 | 58.7° | 55.1° |
| C19 | C20 | C21 | H30 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.1° | 0.1° |
| C20 | C19 | C18 | H28 | 180.0° | 179.9° |
| C19 | C20 | C21 | H31 | 179.9° | 179.9° |
| S1 | C17 | C22 | C21 | 179.8° | 179.7° |
| C17 | S1 | C16 | C15 | 73.7° | 180.0° |
| C17 | S1 | C16 | H26 | 165.8° | 60.0° |
| C17 | S1 | C16 | H27 | 46.8° | 60.0° |
| S1 | C17 | C18 | H28 | 0.2° | 0.4° |
| S1 | C17 | C22 | H32 | 0.2° | 0.4° |
| C16 | S1 | C17 | C22 | 65.8° | 180.0° |
| S1 | C16 | C15 | H26 | 120.5° | 120.0° |
| S1 | C16 | C15 | H27 | 120.5° | 120.0° |
| S1 | C16 | C15 | O5 | 64.0° | 180.0° |
| S1 | C16 | C15 | H24 | 176.5° | 60.0° |
| S1 | C16 | C15 | H25 | 55.4° | 60.0° |
| S1 | C16 | H26 | H27 | 118.5° | 120.0° |
| C17 | C22 | C21 | C20 | 0.1° | 0.1° |
| C17 | C22 | C21 | H32 | 180.0° | 179.9° |
| C22 | C17 | C18 | H28 | 179.9° | 180.0° |
| C17 | C22 | C21 | H31 | 179.9° | 179.9° |
| C20 | C21 | C22 | H31 | 180.0° | 180.0° |
| C21 | C20 | C19 | H29 | 180.0° | 180.0° |
| C20 | C21 | C22 | H32 | 179.9° | 180.0° |
| C22 | C21 | C20 | H30 | 179.9° | 180.0° |
| C3 | C2 | N1 | C7 | 123.6° | 120.0° |
| C3 | C2 | N1 | H17 | 117.4° | 120.0° |
| C3 | C2 | N1 | C1 | 166.5° | 85.0° |
| C3 | C2 | C7 | H17 | 117.4° | 119.9° |
| C3 | C2 | C7 | O4 | 76.8° | 120.0° |
| C3 | C2 | C7 | N2 | 103.3° | 60.0° |
| C3 | C2 | N1 | H1 | 13.5° | 94.7° |
| C2 | C3 | C4 | H13 | 56.0° | 55.0° |
| C2 | C3 | H14 | H15 | 117.6° | 120.0° |
| C16 | C15 | O5 | H24 | 119.4° | 120.0° |
| C16 | C15 | O5 | H25 | 119.5° | 120.0° |
| C16 | C15 | O5 | C1 | 174.1° | 180.0° |
| C16 | C15 | H24 | H25 | 121.7° | 120.0° |
| C15 | C16 | H26 | H27 | 118.5° | 120.0° |
| C2 | N1 | C1 | H1 | 180.0° | 179.7° |
| C2 | N1 | C1 | O5 | 179.5° | 180.0° |
| N1 | C2 | C7 | H17 | 119.6° | 120.1° |
| C2 | N1 | C1 | O1 | 1.6° | 0.0° |
| N1 | C2 | C7 | O4 | 46.2° | 0.0° |
| N1 | C2 | C7 | N2 | 133.7° | 180.0° |
| N1 | C2 | C3 | H14 | 180.0° | 175.0° |
| N1 | C2 | C3 | H15 | 61.5° | 54.9° |
| N1 | C1 | O5 | C15 | 174.3° | 180.0° |
| N1 | C1 | O5 | O1 | 178.8° | 180.0° |
| C1 | N1 | C2 | C7 | 69.9° | 155.0° |
| C1 | N1 | C2 | H17 | 49.1° | 35.0° |
| C15 | O5 | C1 | O1 | 4.5° | 0.0° |
| O5 | C15 | H24 | H25 | 121.6° | 120.0° |
| O5 | C15 | C16 | H26 | 56.4° | 60.0° |
| O5 | C15 | C16 | H27 | 175.5° | 60.0° |
| O5 | C1 | N1 | H1 | 0.4° | 0.3° |
| C1 | O5 | C15 | H24 | 66.5° | 60.0° |
| C1 | O5 | C15 | H25 | 54.6° | 60.0° |
| C2 | C7 | O4 | N2 | 179.9° | 180.0° |
| C2 | C7 | N2 | C8 | 177.5° | 175.0° |
| C7 | C2 | N1 | H1 | 110.1° | 25.2° |
| C2 | C7 | N2 | H3 | 2.5° | 5.1° |
| C7 | C2 | C3 | H14 | 55.3° | 55.0° |
| C7 | C2 | C3 | H15 | 63.2° | 65.0° |
| O1 | C1 | N1 | H1 | 178.4° | 179.7° |
| O4 | C7 | N2 | C8 | 2.7° | 5.0° |
| O4 | C7 | N2 | H3 | 177.4° | 174.9° |
| O4 | C7 | C2 | H17 | 165.8° | 120.0° |
| C7 | N2 | C8 | H3 | 180.0° | 180.0° |
| C7 | N2 | C8 | C14 | 111.5° | 62.5° |
| C7 | N2 | C8 | C9 | 124.8° | 57.4° |
| C7 | N2 | C8 | H2 | 6.9° | 177.5° |
| N2 | C7 | C2 | H17 | 14.1° | 60.0° |
| N2 | C8 | C14 | O3 | 60.9° | 179.1° |
| N2 | C8 | C14 | S2 | 58.5° | 60.9° |
| N2 | C8 | C14 | C9 | 123.2° | 120.0° |
| N2 | C8 | C14 | H2 | 118.8° | 120.0° |
| N2 | C8 | C9 | H2 | 118.4° | 120.1° |
| N2 | C8 | C9 | C10 | 67.8° | 63.5° |
| N2 | C8 | C9 | H4 | 52.7° | 56.4° |
| N2 | C8 | C9 | H5 | 171.7° | 176.4° |
| N2 | C8 | C14 | H23 | 175.7° | 59.2° |
| O3 | C14 | S2 | C8 | 120.0° | 120.0° |
| O3 | C14 | S2 | H23 | 120.7° | 120.0° |
| O3 | C14 | C8 | H23 | 123.4° | 119.9° |
| O3 | C14 | C8 | C9 | 175.9° | 59.1° |
| O3 | C14 | C8 | H2 | 57.9° | 60.9° |
| O3 | C14 | S2 | O6 | 70.5° | 178.6° |
| O3 | C14 | S2 | O7 | 119.8° | 69.8° |
| O3 | C14 | S2 | O8 | 119.8° | 67.0° |
| S2 | C14 | C8 | H23 | 117.2° | 120.0° |
| S2 | C14 | C8 | C9 | 64.7° | 179.1° |
| S2 | C14 | C8 | H2 | 177.3° | 59.2° |
| S2 | C14 | O3 | H16 | 180.0° | 180.0° |
| C14 | S2 | O6 | O7 | 166.4° | 116.0° |
| C14 | S2 | O6 | O8 | 166.4° | 116.1° |
| C14 | S2 | O7 | O8 | 90.0° | 131.6° |
| C14 | S2 | O6 | H33 | 180.0° | 180.0° |
| C14 | C8 | C9 | H2 | 118.1° | 119.9° |
| C14 | C8 | C9 | C10 | 168.7° | 176.5° |
| C14 | C8 | N2 | H3 | 68.5° | 117.4° |
| C14 | C8 | C9 | H4 | 70.7° | 63.6° |
| C14 | C8 | C9 | H5 | 48.2° | 56.5° |
| C8 | C14 | O3 | H16 | 60.2° | 60.0° |
| C8 | C14 | S2 | O6 | 169.5° | 61.4° |
| C8 | C14 | S2 | O7 | 0.3° | 50.2° |
| C8 | C14 | S2 | O8 | 0.3° | 173.0° |
| C8 | C9 | C10 | H4 | 120.5° | 120.0° |
| C8 | C9 | C10 | H5 | 120.5° | 120.0° |
| C8 | C9 | C10 | C13 | 64.5° | 65.6° |
| C8 | C9 | C10 | C11 | 177.1° | 179.6° |
| C9 | C8 | N2 | H3 | 55.2° | 122.6° |
| C8 | C9 | H4 | H5 | 118.5° | 120.0° |
| C8 | C9 | C10 | H18 | 56.9° | 56.8° |
| C9 | C8 | C14 | H23 | 52.5° | 60.8° |
| C9 | C10 | C13 | C11 | 124.2° | 118.7° |
| C9 | C10 | C13 | H18 | 121.4° | 122.5° |
| C9 | C10 | C11 | H18 | 120.1° | 122.7° |
| C9 | C10 | C13 | C12 | 153.0° | 143.5° |
| C9 | C10 | C11 | O2 | 39.2° | 45.2° |
| C9 | C10 | C11 | N3 | 142.1° | 134.7° |
| C10 | C9 | C8 | H2 | 50.7° | 56.6° |
| C10 | C9 | H4 | H5 | 118.6° | 120.0° |
| C9 | C10 | C13 | H19 | 33.9° | 25.3° |
| C9 | C10 | C13 | H20 | 88.0° | 98.4° |
| C13 | C10 | C11 | H18 | 114.3° | 118.7° |
| C10 | C13 | C12 | H19 | 119.0° | 118.1° |
| C10 | C13 | C12 | H20 | 119.0° | 118.1° |
| C10 | C13 | C12 | N3 | 30.5° | 25.5° |
| C13 | C10 | C11 | O2 | 164.7° | 163.9° |
| C13 | C10 | C11 | N3 | 16.6° | 16.1° |
| C13 | C10 | C9 | H4 | 175.0° | 174.4° |
| C13 | C10 | C9 | H5 | 56.0° | 54.4° |
| C10 | C13 | H19 | H20 | 122.8° | 123.8° |
| C10 | C13 | C12 | H21 | 149.4° | 93.5° |
| C10 | C13 | C12 | H22 | 88.3° | 144.4° |
| C11 | C10 | C13 | C12 | 28.8° | 24.8° |
| C10 | C11 | N3 | C12 | 3.4° | 0.7° |
| C10 | C11 | O2 | N3 | 178.5° | 180.0° |
| C11 | C10 | C9 | H4 | 56.6° | 59.6° |
| C11 | C10 | C9 | H5 | 62.4° | 60.4° |
| C10 | C11 | N3 | H12 | 176.6° | 179.6° |
| C11 | C10 | C13 | H19 | 90.3° | 93.4° |
| C11 | C10 | C13 | H20 | 147.8° | 142.9° |
| C13 | C12 | N3 | H21 | 118.8° | 119.1° |
| C13 | C12 | N3 | H22 | 118.8° | 118.9° |
| C13 | C12 | N3 | C11 | 21.9° | 17.3° |
| C13 | C12 | N3 | H12 | 158.1° | 163.0° |
| C12 | C13 | C10 | H18 | 85.6° | 94.0° |
| C12 | C13 | H19 | H20 | 122.8° | 123.9° |
| C13 | C12 | H21 | H22 | 123.4° | 122.0° |
| C12 | N3 | C11 | O2 | 175.3° | 179.4° |
| C12 | N3 | C11 | H12 | 180.0° | 179.8° |
| N3 | C12 | C13 | H19 | 88.5° | 92.6° |
| N3 | C12 | C13 | H20 | 149.6° | 143.6° |
| N3 | C12 | H21 | H22 | 123.4° | 121.9° |
| O2 | C11 | N3 | H12 | 4.7° | 0.4° |
| O2 | C11 | C10 | H18 | 81.0° | 77.4° |
| N3 | C11 | C10 | H18 | 97.8° | 102.6° |
| C11 | N3 | C12 | H21 | 140.7° | 101.8° |
| C11 | N3 | C12 | H22 | 96.9° | 136.2° |
| H1 | N1 | C2 | H17 | 130.9° | 145.3° |
| H2 | C8 | N2 | H3 | 173.1° | 2.6° |
| H2 | C8 | C9 | H4 | 171.2° | 176.5° |
| H2 | C8 | C9 | H5 | 69.8° | 63.5° |
| H2 | C8 | C14 | H23 | 65.5° | 179.2° |
| H4 | C9 | C10 | H18 | 63.6° | 63.1° |
| H5 | C9 | C10 | H18 | 177.4° | 176.9° |
| H6 | C5 | H7 | H8 | 119.9° | 119.9° |
| H6 | C5 | C4 | H13 | 61.7° | 60.0° |
| H7 | C5 | C4 | H13 | 178.3° | 60.0° |
| H8 | C5 | C4 | H13 | 58.3° | 180.0° |
| H9 | C6 | H10 | H11 | 119.9° | 120.0° |
| H9 | C6 | C4 | H13 | 61.7° | 60.0° |
| H10 | C6 | C4 | H13 | 58.3° | 60.0° |
| H11 | C6 | C4 | H13 | 178.3° | 180.0° |
| H12 | N3 | C12 | H21 | 39.3° | 78.0° |
| H12 | N3 | C12 | H22 | 83.1° | 44.0° |
| H13 | C4 | C3 | H14 | 176.7° | 175.0° |
| H13 | C4 | C3 | H15 | 64.8° | 65.0° |
| H14 | C3 | C2 | H17 | 62.1° | 65.0° |
| H15 | C3 | C2 | H17 | 179.4° | 175.0° |
| H16 | O3 | C14 | H23 | 62.3° | 60.0° |
| H18 | C10 | C13 | H19 | 155.4° | 147.8° |
| H18 | C10 | C13 | H20 | 33.4° | 24.1° |
| H19 | C13 | C12 | H21 | 30.3° | 148.4° |
| H19 | C13 | C12 | H22 | 152.7° | 26.3° |
| H20 | C13 | C12 | H21 | 91.6° | 24.5° |
| H20 | C13 | C12 | H22 | 30.8° | 97.6° |
| H23 | C14 | S2 | O6 | 50.2° | 58.6° |
| H23 | C14 | S2 | O7 | 119.5° | 170.2° |
| H23 | C14 | S2 | O8 | 119.5° | 53.0° |
| H24 | C15 | C16 | H26 | 63.0° | 180.0° |
| H24 | C15 | C16 | H27 | 56.0° | 60.0° |
| H25 | C15 | C16 | H26 | 175.9° | 60.0° |
| H25 | C15 | C16 | H27 | 65.1° | 180.0° |
| H28 | C18 | C19 | H29 | 0.0° | 0.1° |
| H29 | C19 | C20 | H30 | 0.0° | 0.0° |
| H30 | C20 | C21 | H31 | 0.1° | 0.0° |
| H31 | C21 | C22 | H32 | 0.1° | 0.0° |
| O6 | S2 | O7 | O8 | 90.0° | 116.8° |
| O7 | S2 | O6 | H33 | 13.6° | 64.0° |
| O8 | S2 | O6 | H33 | 13.6° | 63.9° |
