6CZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | N1 | doub | 1.32Å | 1.34Å | Aromatic |
| C3 | N2 | sing | 1.32Å | 1.33Å | Aromatic |
| N1 | C5 | sing | 1.33Å | 1.36Å | Aromatic |
| N2 | C1 | doub | 1.33Å | 1.37Å | Aromatic |
| C5 | N7 | sing | 1.38Å | 1.45Å | |
| C5 | C2 | doub | 1.41Å | 1.41Å | Aromatic |
| C1 | C2 | sing | 1.41Å | 1.43Å | Aromatic |
| C1 | N5 | sing | 1.37Å | 1.37Å | Aromatic |
| C2 | N6 | sing | 1.35Å | 1.37Å | Aromatic |
| O3 | C13 | sing | 1.43Å | 1.46Å | |
| O4 | C14 | sing | 1.43Å | 1.45Å | |
| C12 | N5 | sing | 1.47Å | 1.45Å | |
| C12 | O2 | sing | 1.44Å | 1.41Å | |
| C12 | C13 | sing | 1.55Å | 1.45Å | |
| N5 | C4 | sing | 1.36Å | 1.36Å | Aromatic |
| N3 | C7 | sing | 1.47Å | 1.41Å | |
| O2 | C11 | sing | 1.44Å | 1.48Å | |
| C13 | C14 | sing | 1.55Å | 1.45Å | |
| O1 | C6 | doub | 1.21Å | 1.32Å | |
| C14 | C11 | sing | 1.54Å | 1.48Å | |
| N6 | C4 | doub | 1.30Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| C11 | C10 | sing | 1.53Å | 1.49Å | |
| C6 | O5 | sing | 1.34Å | 1.26Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C9 | N4 | sing | 1.47Å | 1.44Å | |
| C10 | N4 | sing | 1.47Å | 1.46Å | |
| N4 | C15 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | sing | 1.51Å | 1.48Å | |
| O6 | C16 | doub | 1.21Å | 1.22Å | |
| C16 | C17 | sing | 1.49Å | 1.56Å | |
| C17 | O8 | doub | 1.21Å | 1.25Å | |
| C17 | O7 | sing | 1.35Å | 1.46Å | |
| O7 | C18 | sing | 1.45Å | 1.43Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| N3 | H4 | sing | 1.01Å | 1.00Å | |
| N3 | H5 | sing | 1.01Å | 1.00Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| O3 | H17 | sing | 0.97Å | 0.95Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| O4 | H19 | sing | 0.97Å | 0.95Å | |
| N7 | H20 | sing | 0.97Å | 1.00Å | |
| N7 | H21 | sing | 0.97Å | 1.00Å | |
| O5 | H22 | sing | 0.97Å | 0.95Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C3 | N2 | 122.1° | 122.5° |
| C3 | N1 | C5 | 120.8° | 121.2° |
| N1 | C3 | H1 | 118.9° | 118.8° |
| C3 | N2 | C1 | 120.7° | 120.7° |
| N2 | C3 | H1 | 119.0° | 118.7° |
| N1 | C5 | N7 | 120.6° | 120.8° |
| N1 | C5 | C2 | 119.7° | 118.5° |
| N2 | C1 | C2 | 119.3° | 119.1° |
| N2 | C1 | N5 | 134.7° | 135.0° |
| N7 | C5 | C2 | 119.6° | 120.7° |
| C5 | N7 | H20 | 109.5° | 120.0° |
| C5 | N7 | H21 | 109.4° | 120.0° |
| C5 | C2 | C1 | 117.5° | 118.1° |
| C5 | C2 | N6 | 135.2° | 134.7° |
| C2 | C1 | N5 | 106.1° | 106.0° |
| C1 | C2 | N6 | 107.3° | 107.1° |
| C1 | N5 | C12 | 124.5° | 126.2° |
| C1 | N5 | C4 | 108.4° | 107.5° |
| C2 | N6 | C4 | 108.2° | 109.5° |
| O3 | C13 | C12 | 110.4° | 110.9° |
| O3 | C13 | C14 | 110.9° | 110.8° |
| O3 | C13 | H16 | 110.3° | 110.9° |
| C13 | O3 | H17 | 109.5° | 114.0° |
| O4 | C14 | C13 | 110.0° | 110.5° |
| O4 | C14 | C11 | 109.4° | 110.7° |
| O4 | C14 | H18 | 111.0° | 110.5° |
| C14 | O4 | H19 | 109.5° | 113.9° |
| N5 | C12 | O2 | 107.7° | 110.6° |
| N5 | C12 | C13 | 114.0° | 110.6° |
| C12 | N5 | C4 | 127.1° | 126.3° |
| N5 | C12 | H15 | 109.6° | 110.6° |
| O2 | C12 | C13 | 105.6° | 103.5° |
| C12 | O2 | C11 | 107.6° | 107.0° |
| O2 | C12 | H15 | 110.2° | 110.6° |
| C12 | C13 | C14 | 104.1° | 102.1° |
| C13 | C12 | H15 | 109.7° | 110.7° |
| C12 | C13 | H16 | 110.5° | 110.9° |
| N5 | C4 | N6 | 110.0° | 109.9° |
| N5 | C4 | H2 | 125.0° | 125.0° |
| N3 | C7 | C6 | 108.5° | 109.5° |
| N3 | C7 | C8 | 108.0° | 109.5° |
| N3 | C7 | H3 | 110.1° | 109.5° |
| C7 | N3 | H4 | 109.5° | 111.0° |
| C7 | N3 | H5 | 109.4° | 111.0° |
| O2 | C11 | C14 | 105.0° | 107.4° |
| O2 | C11 | C10 | 108.9° | 109.9° |
| O2 | C11 | H14 | 109.7° | 109.9° |
| C13 | C14 | C11 | 104.6° | 104.0° |
| C14 | C13 | H16 | 110.4° | 111.0° |
| C13 | C14 | H18 | 111.0° | 110.5° |
| O1 | C6 | C7 | 118.3° | 120.0° |
| O1 | C6 | O5 | 122.8° | 120.0° |
| C14 | C11 | C10 | 113.6° | 109.9° |
| C14 | C11 | H14 | 109.8° | 109.9° |
| C11 | C14 | H18 | 110.7° | 110.4° |
| N6 | C4 | H2 | 125.0° | 125.1° |
| C6 | C7 | C8 | 113.2° | 109.5° |
| C7 | C6 | O5 | 118.9° | 120.0° |
| C6 | C7 | H3 | 108.8° | 109.5° |
| C7 | C8 | C9 | 111.3° | 109.5° |
| C8 | C7 | H3 | 108.2° | 109.4° |
| C7 | C8 | H7 | 109.0° | 109.5° |
| C7 | C8 | H8 | 109.0° | 109.5° |
| C11 | C10 | N4 | 117.7° | 109.5° |
| C11 | C10 | H12 | 107.4° | 109.5° |
| C11 | C10 | H13 | 107.4° | 109.4° |
| C10 | C11 | H14 | 109.7° | 109.9° |
| C6 | O5 | H22 | 109.5° | 117.1° |
| C8 | C9 | N4 | 115.8° | 109.5° |
| C9 | C8 | H7 | 109.0° | 109.5° |
| C9 | C8 | H8 | 109.0° | 109.4° |
| C8 | C9 | H9 | 107.9° | 109.5° |
| C8 | C9 | H10 | 107.9° | 109.5° |
| C9 | N4 | C10 | 117.5° | 111.0° |
| C9 | N4 | C15 | 111.0° | 111.0° |
| N4 | C9 | H9 | 107.8° | 109.4° |
| N4 | C9 | H10 | 107.8° | 109.5° |
| C10 | N4 | C15 | 112.0° | 111.1° |
| N4 | C10 | H12 | 107.4° | 109.5° |
| N4 | C10 | H13 | 107.4° | 109.5° |
| N4 | C15 | C16 | 115.0° | 109.5° |
| N4 | C15 | H23 | 108.1° | 109.5° |
| N4 | C15 | H24 | 108.1° | 109.5° |
| C15 | C16 | O6 | 120.1° | 120.0° |
| C15 | C16 | C17 | 120.2° | 120.0° |
| C16 | C15 | H23 | 108.1° | 109.4° |
| C16 | C15 | H24 | 108.1° | 109.5° |
| O6 | C16 | C17 | 119.7° | 120.0° |
| C16 | C17 | O8 | 119.0° | 120.0° |
| C16 | C17 | O7 | 121.9° | 120.0° |
| O8 | C17 | O7 | 117.4° | 120.0° |
| C17 | O7 | C18 | 113.7° | 117.0° |
| O7 | C18 | C19 | 109.0° | 109.5° |
| O7 | C18 | H25 | 109.6° | 109.5° |
| O7 | C18 | H26 | 109.6° | 109.5° |
| C19 | C18 | H25 | 109.6° | 109.4° |
| C19 | C18 | H26 | 109.6° | 109.5° |
| C18 | C19 | H27 | 109.5° | 109.5° |
| C18 | C19 | H28 | 109.5° | 109.5° |
| C18 | C19 | H29 | 109.5° | 109.5° |
| H4 | N3 | H5 | 109.5° | 111.0° |
| H7 | C8 | H8 | 109.5° | 109.4° |
| H9 | C9 | H10 | 109.5° | 109.5° |
| H12 | C10 | H13 | 109.5° | 109.4° |
| H20 | N7 | H21 | 109.5° | 120.0° |
| H23 | C15 | H24 | 109.5° | 109.5° |
| H25 | C18 | H26 | 109.5° | 109.4° |
| H27 | C19 | H28 | 109.4° | 109.5° |
| H27 | C19 | H29 | 109.5° | 109.5° |
| H28 | C19 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C3 | N2 | H1 | 180.0° | 180.0° |
| N1 | C3 | N2 | C1 | 0.1° | 0.0° |
| C3 | N1 | C5 | N7 | 179.8° | 179.9° |
| C3 | N1 | C5 | C2 | 0.0° | 0.0° |
| N2 | C3 | N1 | C5 | 0.0° | 0.0° |
| C3 | N2 | C1 | C2 | 0.0° | 0.0° |
| C3 | N2 | C1 | N5 | 179.6° | 180.0° |
| N1 | C5 | N7 | C2 | 179.8° | 179.9° |
| N1 | C5 | C2 | C1 | 0.1° | 0.0° |
| N1 | C5 | C2 | N6 | 179.9° | 180.0° |
| C5 | N1 | C3 | H1 | 180.0° | 180.0° |
| N1 | C5 | N7 | H20 | 0.0° | 0.0° |
| N1 | C5 | N7 | H21 | 120.0° | 180.0° |
| N2 | C1 | C2 | C5 | 0.1° | 0.0° |
| N2 | C1 | C2 | N5 | 179.7° | 180.0° |
| N2 | C1 | C2 | N6 | 179.9° | 180.0° |
| N2 | C1 | N5 | C12 | 1.2° | 0.1° |
| N2 | C1 | N5 | C4 | 179.7° | 180.0° |
| C1 | N2 | C3 | H1 | 180.0° | 180.0° |
| N7 | C5 | C2 | C1 | 179.9° | 179.9° |
| N7 | C5 | C2 | N6 | 0.1° | 0.0° |
| C5 | N7 | H20 | H21 | 120.0° | 180.0° |
| C5 | C2 | C1 | N6 | 180.0° | 180.0° |
| C5 | C2 | C1 | N5 | 179.6° | 180.0° |
| C5 | C2 | N6 | C4 | 179.9° | 180.0° |
| C2 | C5 | N7 | H20 | 179.8° | 180.0° |
| C2 | C5 | N7 | H21 | 59.8° | 0.1° |
| C2 | C1 | N5 | C12 | 179.2° | 180.0° |
| C2 | C1 | N5 | C4 | 0.7° | 0.0° |
| C1 | C2 | N6 | C4 | 0.1° | 0.0° |
| N5 | C1 | C2 | N6 | 0.4° | 0.0° |
| C1 | N5 | C12 | C4 | 178.2° | 180.0° |
| C1 | N5 | C12 | O2 | 103.7° | 156.4° |
| C1 | N5 | C12 | C13 | 139.5° | 89.5° |
| C1 | N5 | C4 | N6 | 0.8° | 0.0° |
| C1 | N5 | C4 | H2 | 179.2° | 180.0° |
| C1 | N5 | C12 | H15 | 16.2° | 33.6° |
| C2 | N6 | C4 | N5 | 0.6° | 0.0° |
| C2 | N6 | C4 | H2 | 179.4° | 180.0° |
| O3 | C13 | C14 | O4 | 35.7° | 20.4° |
| O3 | C13 | C12 | N5 | 87.3° | 86.3° |
| O3 | C13 | C12 | O2 | 154.7° | 155.2° |
| O3 | C13 | C12 | C14 | 119.1° | 118.1° |
| O3 | C13 | C12 | H16 | 122.3° | 123.6° |
| O3 | C13 | C14 | H16 | 122.6° | 123.6° |
| O3 | C13 | C14 | C11 | 153.1° | 139.2° |
| O3 | C13 | C12 | H15 | 36.0° | 36.7° |
| O3 | C13 | C14 | H18 | 87.5° | 102.3° |
| O4 | C14 | C13 | C12 | 83.0° | 97.8° |
| O4 | C14 | C11 | O2 | 97.4° | 120.6° |
| O4 | C14 | C13 | C11 | 117.4° | 118.8° |
| O4 | C14 | C13 | H18 | 123.2° | 122.7° |
| O4 | C14 | C11 | H18 | 122.6° | 122.7° |
| O4 | C14 | C11 | C10 | 143.7° | 119.9° |
| O4 | C14 | C11 | H14 | 20.5° | 1.1° |
| O4 | C14 | C13 | H16 | 158.3° | 144.0° |
| N5 | C12 | O2 | C13 | 122.1° | 118.5° |
| N5 | C12 | O2 | H15 | 119.5° | 122.8° |
| N5 | C12 | C13 | H15 | 123.3° | 122.9° |
| N5 | C12 | O2 | C11 | 144.8° | 158.6° |
| N5 | C12 | C13 | C14 | 153.6° | 155.6° |
| C12 | N5 | C4 | N6 | 179.3° | 180.0° |
| C12 | N5 | C4 | H2 | 0.7° | 0.0° |
| N5 | C12 | C13 | H16 | 35.0° | 37.4° |
| O2 | C12 | C13 | H15 | 118.7° | 118.5° |
| O2 | C12 | N5 | C4 | 74.5° | 23.5° |
| O2 | C12 | C13 | C14 | 35.6° | 37.1° |
| C12 | O2 | C11 | C14 | 1.3° | 26.4° |
| C12 | O2 | C11 | C10 | 123.2° | 145.9° |
| C12 | O2 | C11 | H14 | 116.7° | 93.1° |
| O2 | C12 | C13 | H16 | 83.0° | 81.2° |
| C13 | C12 | N5 | C4 | 42.3° | 90.6° |
| C13 | C12 | O2 | C11 | 22.7° | 40.0° |
| C12 | C13 | C14 | H16 | 118.6° | 118.2° |
| C12 | C13 | C14 | C11 | 34.4° | 21.0° |
| C12 | C13 | O3 | H17 | 180.0° | 180.0° |
| C12 | C13 | C14 | H18 | 153.7° | 139.5° |
| N5 | C4 | N6 | H2 | 180.0° | 179.9° |
| C4 | N5 | C12 | H15 | 165.6° | 146.4° |
| N3 | C7 | C6 | O1 | 113.4° | 25.7° |
| N3 | C7 | C6 | C8 | 119.9° | 120.0° |
| N3 | C7 | C6 | H3 | 119.7° | 120.0° |
| N3 | C7 | C8 | H3 | 119.2° | 120.0° |
| N3 | C7 | C6 | O5 | 65.7° | 154.4° |
| N3 | C7 | C8 | C9 | 115.7° | 65.8° |
| C7 | N3 | H4 | H5 | 120.0° | 124.0° |
| N3 | C7 | C8 | H7 | 4.5° | 54.3° |
| N3 | C7 | C8 | H8 | 124.0° | 174.3° |
| O2 | C11 | C14 | C13 | 20.4° | 1.9° |
| O2 | C11 | C14 | C10 | 118.9° | 119.5° |
| O2 | C11 | C14 | H14 | 117.9° | 119.5° |
| O2 | C11 | C10 | H14 | 120.1° | 121.0° |
| O2 | C11 | C10 | N4 | 167.5° | 59.8° |
| O2 | C11 | C10 | H12 | 71.3° | 60.2° |
| O2 | C11 | C10 | H13 | 46.3° | 179.8° |
| C11 | O2 | C12 | H15 | 95.7° | 78.6° |
| O2 | C11 | C14 | H18 | 140.0° | 116.7° |
| C13 | C14 | C11 | H18 | 119.6° | 118.6° |
| C13 | C14 | C11 | C10 | 98.5° | 121.4° |
| C13 | C14 | C11 | H14 | 138.3° | 117.6° |
| C14 | C13 | C12 | H15 | 83.1° | 81.4° |
| C14 | C13 | O3 | H17 | 65.1° | 67.3° |
| C13 | C14 | O4 | H19 | 180.0° | 61.4° |
| O1 | C6 | C7 | O5 | 179.1° | 180.0° |
| O1 | C6 | C7 | C8 | 126.7° | 94.3° |
| O1 | C6 | C7 | H3 | 6.3° | 145.7° |
| O1 | C6 | O5 | H22 | 0.0° | 0.0° |
| C14 | C11 | C10 | H14 | 123.3° | 121.0° |
| C14 | C11 | C10 | N4 | 75.8° | 177.8° |
| C14 | C11 | C10 | H12 | 45.3° | 57.8° |
| C14 | C11 | C10 | H13 | 163.0° | 62.2° |
| C11 | C14 | C13 | H16 | 84.3° | 97.2° |
| C11 | C14 | O4 | H19 | 65.6° | 176.1° |
| C6 | C7 | C8 | H3 | 120.6° | 120.0° |
| C6 | C7 | C8 | C9 | 124.1° | 174.2° |
| C6 | C7 | N3 | H4 | 180.0° | 60.0° |
| C6 | C7 | N3 | H5 | 60.0° | 176.0° |
| C6 | C7 | C8 | H7 | 115.6° | 65.7° |
| C6 | C7 | C8 | H8 | 3.8° | 54.2° |
| C7 | C6 | O5 | H22 | 179.1° | 180.0° |
| C8 | C7 | C6 | O5 | 54.2° | 85.6° |
| C7 | C8 | C9 | H7 | 120.3° | 120.0° |
| C7 | C8 | C9 | H8 | 120.3° | 120.0° |
| C7 | C8 | C9 | N4 | 150.8° | 178.0° |
| C8 | C7 | N3 | H4 | 56.9° | 60.0° |
| C8 | C7 | N3 | H5 | 176.9° | 64.0° |
| C7 | C8 | H7 | H8 | 119.1° | 120.0° |
| C7 | C8 | C9 | H9 | 88.3° | 58.0° |
| C7 | C8 | C9 | H10 | 29.9° | 62.0° |
| C11 | C10 | N4 | C9 | 23.9° | 164.0° |
| C11 | C10 | N4 | H12 | 121.2° | 120.0° |
| C11 | C10 | N4 | H13 | 121.2° | 120.0° |
| C11 | C10 | N4 | C15 | 154.1° | 72.0° |
| C11 | C10 | H12 | H13 | 116.3° | 120.0° |
| C10 | C11 | C14 | H18 | 21.1° | 2.8° |
| O5 | C6 | C7 | H3 | 174.6° | 34.4° |
| C8 | C9 | N4 | H9 | 120.9° | 120.0° |
| C8 | C9 | N4 | H10 | 120.9° | 120.0° |
| C8 | C9 | N4 | C10 | 82.0° | 72.4° |
| C8 | C9 | N4 | C15 | 48.7° | 163.6° |
| C9 | C8 | C7 | H3 | 3.4° | 54.2° |
| C9 | C8 | H7 | H8 | 119.2° | 119.9° |
| C8 | C9 | H9 | H10 | 117.1° | 120.0° |
| C9 | N4 | C10 | C15 | 130.2° | 124.0° |
| C9 | N4 | C15 | C16 | 142.4° | 66.0° |
| N4 | C9 | C8 | H7 | 30.5° | 62.0° |
| N4 | C9 | C8 | H8 | 89.0° | 58.0° |
| N4 | C9 | H9 | H10 | 117.1° | 120.0° |
| C9 | N4 | C10 | H12 | 145.1° | 44.0° |
| C9 | N4 | C10 | H13 | 97.3° | 76.0° |
| C9 | N4 | C15 | H23 | 96.8° | 174.0° |
| C9 | N4 | C15 | H24 | 21.7° | 54.0° |
| C10 | N4 | C15 | C16 | 84.1° | 170.0° |
| C10 | N4 | C9 | H9 | 157.1° | 47.6° |
| C10 | N4 | C9 | H10 | 38.9° | 167.6° |
| N4 | C10 | H12 | H13 | 116.3° | 120.0° |
| N4 | C10 | C11 | H14 | 47.4° | 61.2° |
| C10 | N4 | C15 | H23 | 36.7° | 50.0° |
| C10 | N4 | C15 | H24 | 155.1° | 70.0° |
| N4 | C15 | C16 | H23 | 120.8° | 120.1° |
| N4 | C15 | C16 | H24 | 120.8° | 120.0° |
| N4 | C15 | C16 | O6 | 44.2° | 0.0° |
| N4 | C15 | C16 | C17 | 137.0° | 180.0° |
| C15 | N4 | C9 | H9 | 72.3° | 76.4° |
| C15 | N4 | C9 | H10 | 169.6° | 43.6° |
| C15 | N4 | C10 | H12 | 84.7° | 168.0° |
| C15 | N4 | C10 | H13 | 32.9° | 48.0° |
| N4 | C15 | H23 | H24 | 117.5° | 120.0° |
| C15 | C16 | O6 | C17 | 178.8° | 179.9° |
| C15 | C16 | C17 | O8 | 46.8° | 0.1° |
| C15 | C16 | C17 | O7 | 148.5° | 180.0° |
| C16 | C15 | H23 | H24 | 117.5° | 120.0° |
| O6 | C16 | C17 | O8 | 132.0° | 180.0° |
| O6 | C16 | C17 | O7 | 32.7° | 0.1° |
| O6 | C16 | C15 | H23 | 76.6° | 120.0° |
| O6 | C16 | C15 | H24 | 165.0° | 120.0° |
| C16 | C17 | O8 | O7 | 165.3° | 179.9° |
| C16 | C17 | O7 | C18 | 133.6° | 179.9° |
| C17 | C16 | C15 | H23 | 102.2° | 59.9° |
| C17 | C16 | C15 | H24 | 16.2° | 60.0° |
| O8 | C17 | O7 | C18 | 61.5° | 0.0° |
| C17 | O7 | C18 | C19 | 149.5° | 180.0° |
| C17 | O7 | C18 | H25 | 29.5° | 60.0° |
| C17 | O7 | C18 | H26 | 90.6° | 60.0° |
| O7 | C18 | C19 | H25 | 119.9° | 120.0° |
| O7 | C18 | C19 | H26 | 119.9° | 120.1° |
| O7 | C18 | H25 | H26 | 120.2° | 120.0° |
| O7 | C18 | C19 | H27 | 180.0° | 59.9° |
| O7 | C18 | C19 | H28 | 60.0° | 180.0° |
| O7 | C18 | C19 | H29 | 60.0° | 60.1° |
| C19 | C18 | H25 | H26 | 120.2° | 120.0° |
| C18 | C19 | H27 | H28 | 120.0° | 120.1° |
| C18 | C19 | H27 | H29 | 120.0° | 120.0° |
| C18 | C19 | H28 | H29 | 120.0° | 120.0° |
| H3 | C7 | N3 | H4 | 61.1° | 180.0° |
| H3 | C7 | N3 | H5 | 58.9° | 56.0° |
| H3 | C7 | C8 | H7 | 123.7° | 174.2° |
| H3 | C7 | C8 | H8 | 116.9° | 65.8° |
| H7 | C8 | C9 | H9 | 151.4° | 178.1° |
| H7 | C8 | C9 | H10 | 90.4° | 58.0° |
| H8 | C8 | C9 | H9 | 32.0° | 62.0° |
| H8 | C8 | C9 | H10 | 150.1° | 178.0° |
| H12 | C10 | C11 | H14 | 168.6° | 178.8° |
| H13 | C10 | C11 | H14 | 73.8° | 58.8° |
| H14 | C11 | C14 | H18 | 102.1° | 123.8° |
| H15 | C12 | C13 | H16 | 158.3° | 160.3° |
| H16 | C13 | O3 | H17 | 57.6° | 56.4° |
| H16 | C13 | C14 | H18 | 35.1° | 21.3° |
| H18 | C14 | O4 | H19 | 56.8° | 61.2° |
| H25 | C18 | C19 | H27 | 60.1° | 60.0° |
| H25 | C18 | C19 | H28 | 179.9° | 60.0° |
| H25 | C18 | C19 | H29 | 59.9° | 180.0° |
| H26 | C18 | C19 | H27 | 60.1° | NaN° |
| H26 | C18 | C19 | H28 | 59.9° | 59.9° |
| H26 | C18 | C19 | H29 | 179.9° | 60.0° |
| H27 | C19 | H28 | H29 | 120.0° | 119.9° |
