Q8T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N7 | C21 | doub | 1.33Å | 1.34Å | Aromatic |
| N7 | C20 | sing | 1.25Å | 1.33Å | Aromatic |
| N8 | C21 | sing | 1.36Å | 1.36Å | Aromatic |
| N8 | C22 | sing | 1.35Å | 1.36Å | Aromatic |
| C21 | C25 | sing | 1.43Å | 1.38Å | Aromatic |
| C20 | N6 | doub | 1.35Å | 1.33Å | Aromatic |
| C22 | C23 | doub | 1.33Å | 1.36Å | Aromatic |
| C25 | C23 | sing | 1.41Å | 1.43Å | Aromatic |
| C25 | C19 | doub | 1.43Å | 1.38Å | Aromatic |
| N6 | C19 | sing | 1.32Å | 1.35Å | Aromatic |
| C23 | C24 | sing | 1.57Å | 1.52Å | |
| C19 | N5 | sing | 1.33Å | 1.36Å | |
| C24 | N1 | sing | 1.44Å | 1.46Å | |
| N5 | C10 | sing | 1.40Å | 1.41Å | |
| C1 | N1 | sing | 1.47Å | 1.47Å | |
| C11 | C10 | doub | 1.36Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| N1 | C2 | sing | 1.49Å | 1.46Å | |
| C10 | C9 | sing | 1.40Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.43Å | 1.39Å | Aromatic |
| C9 | C8 | doub | 1.31Å | 1.38Å | Aromatic |
| C2 | C3 | sing | 1.55Å | 1.50Å | |
| C13 | C8 | sing | 1.41Å | 1.40Å | Aromatic |
| C13 | N3 | sing | 1.38Å | 1.44Å | |
| C8 | O2 | sing | 1.45Å | 1.38Å | |
| C18 | N3 | sing | 1.47Å | 1.47Å | |
| C18 | C17 | sing | 1.53Å | 1.51Å | |
| C3 | C4 | sing | 1.48Å | 1.52Å | |
| N3 | C14 | sing | 1.47Å | 1.46Å | |
| O2 | C7 | sing | 1.40Å | 1.45Å | |
| C5 | N2 | sing | 1.47Å | 1.45Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C17 | N4 | sing | 1.47Å | 1.46Å | |
| N2 | C4 | sing | 1.53Å | 1.46Å | |
| N2 | C6 | sing | 1.38Å | 1.35Å | |
| C6 | O1 | doub | 1.14Å | 1.22Å | |
| C14 | C15 | sing | 1.53Å | 1.51Å | |
| N4 | C15 | sing | 1.47Å | 1.46Å | |
| N4 | C16 | sing | 1.47Å | 1.48Å | |
| C4 | H1 | sing | 1.15Å | 1.10Å | |
| C4 | H2 | sing | 1.07Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.05Å | 1.10Å | |
| C7 | H8 | sing | 1.15Å | 1.10Å | |
| C9 | H9 | sing | 1.06Å | 1.08Å | |
| C11 | H10 | sing | 1.07Å | 1.08Å | |
| C12 | H11 | sing | 1.05Å | 1.08Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.08Å | 1.10Å | |
| C24 | H21 | sing | 1.07Å | 1.10Å | |
| N8 | H22 | sing | 0.95Å | 1.00Å | |
| C22 | H23 | sing | 1.08Å | 1.08Å | |
| C20 | H24 | sing | 1.08Å | 1.08Å | |
| N5 | H25 | sing | 1.02Å | 1.00Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H30 | sing | 1.09Å | 1.10Å | |
| C16 | H31 | sing | 1.09Å | 1.10Å | |
| C16 | H32 | sing | 1.09Å | 1.10Å | |
| C3 | H33 | sing | 1.11Å | 1.10Å | |
| C3 | H34 | sing | 1.04Å | 1.10Å | |
| C2 | H35 | sing | 1.16Å | 1.10Å | |
| C2 | H36 | sing | 1.00Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | N7 | C20 | 113.3° | 123.6° |
| N7 | C21 | N8 | 126.8° | 136.7° |
| N7 | C21 | C25 | 125.6° | 118.0° |
| N7 | C20 | N6 | 128.6° | 120.2° |
| N7 | C20 | H24 | 115.7° | 122.8° |
| C21 | N8 | C22 | 108.9° | 110.8° |
| N8 | C21 | C25 | 107.5° | 104.9° |
| C21 | N8 | H22 | 125.5° | 125.0° |
| N8 | C22 | C23 | 110.1° | 109.4° |
| C22 | N8 | H22 | 125.5° | 124.1° |
| N8 | C22 | H23 | 124.9° | 128.7° |
| C21 | C25 | C23 | 107.8° | 106.8° |
| C21 | C25 | C19 | 114.4° | 117.1° |
| C20 | N6 | C19 | 114.4° | 123.3° |
| N6 | C20 | H24 | 115.7° | 115.6° |
| C22 | C23 | C25 | 105.6° | 107.5° |
| C22 | C23 | C24 | 131.6° | 124.8° |
| C23 | C22 | H23 | 125.0° | 121.9° |
| C23 | C25 | C19 | 137.3° | 135.7° |
| C25 | C23 | C24 | 122.5° | 127.4° |
| C25 | C19 | N6 | 123.7° | 117.0° |
| C25 | C19 | N5 | 117.6° | 122.0° |
| N6 | C19 | N5 | 118.7° | 120.4° |
| C23 | C24 | N1 | 121.5° | 113.5° |
| C23 | C24 | H20 | 106.4° | 110.5° |
| C23 | C24 | H21 | 106.4° | 107.1° |
| C19 | N5 | C10 | 128.6° | 134.5° |
| C19 | N5 | H25 | 115.7° | 113.2° |
| C24 | N1 | C1 | 110.7° | 105.8° |
| C24 | N1 | C2 | 109.6° | 109.5° |
| N1 | C24 | H20 | 106.4° | 108.0° |
| N1 | C24 | H21 | 106.4° | 110.2° |
| N5 | C10 | C11 | 122.1° | 121.5° |
| N5 | C10 | C9 | 118.4° | 118.3° |
| C10 | N5 | H25 | 115.7° | 112.3° |
| C1 | N1 | C2 | 112.6° | 104.6° |
| N1 | C1 | H17 | 109.5° | 109.4° |
| N1 | C1 | H18 | 109.5° | 109.5° |
| N1 | C1 | H19 | 109.5° | 109.5° |
| C10 | C11 | C12 | 120.4° | 119.9° |
| C11 | C10 | C9 | 119.5° | 120.2° |
| C10 | C11 | H10 | 119.8° | 123.8° |
| C11 | C12 | C13 | 120.6° | 120.8° |
| C12 | C11 | H10 | 119.8° | 116.3° |
| C11 | C12 | H11 | 119.7° | 121.2° |
| N1 | C2 | C3 | 113.5° | 108.4° |
| N1 | C2 | H35 | 108.4° | 105.0° |
| N1 | C2 | H36 | 108.4° | 108.1° |
| C10 | C9 | C8 | 120.0° | 119.8° |
| C10 | C9 | H9 | 120.0° | 119.0° |
| C12 | C13 | C8 | 118.3° | 115.1° |
| C12 | C13 | N3 | 122.7° | 122.7° |
| C13 | C12 | H11 | 119.7° | 117.6° |
| C9 | C8 | C13 | 121.1° | 123.8° |
| C9 | C8 | O2 | 122.9° | 120.3° |
| C8 | C9 | H9 | 120.0° | 121.0° |
| C2 | C3 | C4 | 112.5° | 106.5° |
| C2 | C3 | H33 | 108.7° | 109.9° |
| C2 | C3 | H34 | 108.7° | 108.3° |
| C3 | C2 | H35 | 108.4° | 106.2° |
| C3 | C2 | H36 | 108.5° | 114.0° |
| C8 | C13 | N3 | 119.1° | 121.6° |
| C13 | C8 | O2 | 116.0° | 115.9° |
| C13 | N3 | C18 | 116.2° | 111.0° |
| C13 | N3 | C14 | 115.3° | 111.0° |
| C8 | O2 | C7 | 117.8° | 117.0° |
| N3 | C18 | C17 | 110.8° | 109.4° |
| C18 | N3 | C14 | 110.9° | 110.9° |
| N3 | C18 | H26 | 109.1° | 109.6° |
| N3 | C18 | H27 | 109.1° | 109.5° |
| C18 | C17 | N4 | 110.9° | 109.4° |
| C17 | C18 | H26 | 109.1° | 109.5° |
| C17 | C18 | H27 | 109.1° | 109.4° |
| C18 | C17 | H28 | 109.1° | 109.5° |
| C18 | C17 | H29 | 109.1° | 109.5° |
| C3 | C4 | N2 | 110.8° | 110.1° |
| C3 | C4 | H1 | 109.1° | 111.2° |
| C3 | C4 | H2 | 109.1° | 111.9° |
| C4 | C3 | H33 | 108.7° | 108.0° |
| C4 | C3 | H34 | 108.7° | 111.8° |
| N3 | C14 | C15 | 110.7° | 109.3° |
| N3 | C14 | H12 | 109.2° | 109.5° |
| N3 | C14 | H13 | 109.1° | 109.5° |
| O2 | C7 | C6 | 108.5° | 109.6° |
| O2 | C7 | H7 | 109.7° | 107.2° |
| O2 | C7 | H8 | 109.7° | 110.2° |
| C5 | N2 | C4 | 116.7° | 120.6° |
| C5 | N2 | C6 | 123.8° | 126.8° |
| N2 | C5 | H3 | 109.5° | 109.5° |
| N2 | C5 | H4 | 109.5° | 109.5° |
| N2 | C5 | H5 | 109.5° | 109.5° |
| C7 | C6 | N2 | 118.0° | 116.3° |
| C7 | C6 | O1 | 120.0° | 119.2° |
| C6 | C7 | H7 | 109.7° | 110.9° |
| C6 | C7 | H8 | 109.7° | 109.9° |
| C17 | N4 | C15 | 109.3° | 110.8° |
| C17 | N4 | C16 | 110.6° | 111.0° |
| N4 | C17 | H28 | 109.1° | 109.5° |
| N4 | C17 | H29 | 109.1° | 109.5° |
| C4 | N2 | C6 | 119.5° | 112.6° |
| N2 | C4 | H1 | 109.1° | 105.8° |
| N2 | C4 | H2 | 109.1° | 107.9° |
| N2 | C6 | O1 | 121.9° | 124.5° |
| C14 | C15 | N4 | 111.0° | 109.4° |
| C15 | C14 | H12 | 109.2° | 109.5° |
| C15 | C14 | H13 | 109.2° | 109.4° |
| C14 | C15 | H14 | 109.1° | 109.5° |
| C14 | C15 | H15 | 109.1° | 109.5° |
| C15 | N4 | C16 | 110.5° | 111.0° |
| N4 | C15 | H14 | 109.1° | 109.5° |
| N4 | C15 | H15 | 109.1° | 109.5° |
| N4 | C16 | H30 | 109.5° | 109.4° |
| N4 | C16 | H31 | 109.5° | 109.4° |
| N4 | C16 | H32 | 109.5° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.6° |
| H3 | C5 | H4 | 109.5° | 109.4° |
| H3 | C5 | H5 | 109.5° | 109.5° |
| H4 | C5 | H5 | 109.5° | 109.4° |
| H7 | C7 | H8 | 109.5° | 108.9° |
| H12 | C14 | H13 | 109.5° | 109.6° |
| H14 | C15 | H15 | 109.4° | 109.5° |
| H17 | C1 | H18 | 109.5° | 109.4° |
| H17 | C1 | H19 | 109.4° | 109.4° |
| H18 | C1 | H19 | 109.5° | 109.5° |
| H20 | C24 | H21 | 109.5° | 107.3° |
| H26 | C18 | H27 | 109.5° | 109.5° |
| H28 | C17 | H29 | 109.5° | 109.5° |
| H30 | C16 | H31 | 109.5° | 109.5° |
| H30 | C16 | H32 | 109.4° | 109.5° |
| H31 | C16 | H32 | 109.4° | 109.5° |
| H33 | C3 | H34 | 109.5° | 112.3° |
| H35 | C2 | H36 | 109.5° | 114.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N7 | C21 | N8 | C25 | 175.4° | 173.2° |
| N7 | C21 | N8 | C22 | 173.6° | 174.5° |
| C21 | N7 | C20 | N6 | 1.5° | 10.7° |
| N7 | C21 | C25 | C23 | 172.5° | 171.6° |
| N7 | C21 | C25 | C19 | 1.1° | 2.3° |
| N7 | C21 | N8 | H22 | 6.4° | 8.1° |
| C21 | N7 | C20 | H24 | 178.5° | 176.8° |
| C20 | N7 | C21 | N8 | 173.7° | 178.3° |
| C20 | N7 | C21 | C25 | 0.9° | 9.1° |
| N7 | C20 | N6 | H24 | 180.0° | 167.0° |
| N7 | C20 | N6 | C19 | 0.0° | 5.2° |
| C21 | N8 | C22 | H22 | 180.0° | 177.4° |
| C21 | N8 | C22 | C23 | 0.1° | 5.6° |
| N8 | C21 | C25 | C23 | 2.9° | 3.2° |
| N8 | C21 | C25 | C19 | 176.6° | 177.1° |
| C21 | N8 | C22 | H23 | 179.8° | 173.3° |
| C22 | N8 | C21 | C25 | 1.8° | 1.3° |
| N8 | C22 | C23 | H23 | 180.0° | 179.0° |
| N8 | C22 | C23 | C25 | 1.9° | 7.5° |
| N8 | C22 | C23 | C24 | 172.2° | 177.3° |
| C21 | C25 | C23 | C22 | 3.0° | 6.6° |
| C21 | C25 | C23 | C19 | 171.5° | 172.2° |
| C21 | C25 | C19 | N6 | 2.8° | 2.4° |
| C21 | C25 | C23 | C24 | 171.8° | 178.4° |
| C21 | C25 | C19 | N5 | 175.7° | 174.1° |
| C25 | C21 | N8 | H22 | 178.2° | 178.6° |
| C20 | N6 | C19 | C25 | 2.3° | 1.2° |
| C20 | N6 | C19 | N5 | 176.2° | 173.0° |
| C22 | C23 | C25 | C24 | 174.8° | 175.0° |
| C22 | C23 | C25 | C19 | 174.5° | 178.8° |
| C22 | C23 | C24 | N1 | 128.9° | 85.1° |
| C22 | C23 | C24 | H20 | 109.4° | 153.4° |
| C22 | C23 | C24 | H21 | 7.2° | 36.8° |
| C23 | C22 | N8 | H22 | 179.9° | 177.0° |
| C23 | C25 | C19 | N6 | 168.3° | 174.0° |
| C23 | C25 | C19 | N5 | 13.2° | 14.3° |
| C25 | C23 | C24 | N1 | 57.8° | 100.7° |
| C25 | C23 | C24 | H20 | 63.8° | 20.8° |
| C25 | C23 | C24 | H21 | 179.5° | 137.4° |
| C25 | C23 | C22 | H23 | 178.1° | 171.5° |
| C25 | C19 | N6 | N5 | 178.5° | 171.8° |
| C19 | C25 | C23 | C24 | 0.3° | 6.2° |
| C25 | C19 | N5 | C10 | 172.3° | 176.4° |
| C25 | C19 | N5 | H25 | 7.7° | 6.6° |
| N6 | C19 | N5 | C10 | 9.1° | 5.0° |
| C19 | N6 | C20 | H24 | 180.0° | 172.3° |
| N6 | C19 | N5 | H25 | 170.9° | 178.1° |
| C23 | C24 | N1 | H20 | 121.7° | 122.9° |
| C23 | C24 | N1 | H21 | 121.7° | 120.1° |
| C23 | C24 | N1 | C1 | 62.0° | 2.4° |
| C23 | C24 | N1 | C2 | 173.2° | 114.6° |
| C23 | C24 | H20 | H21 | 114.6° | 116.5° |
| C24 | C23 | C22 | H23 | 7.8° | 3.7° |
| C19 | N5 | C10 | H25 | 180.0° | 176.9° |
| C19 | N5 | C10 | C11 | 45.7° | 17.0° |
| C19 | N5 | C10 | C9 | 136.1° | 161.7° |
| C24 | N1 | C1 | C2 | 123.0° | 115.6° |
| C24 | N1 | C2 | C3 | 164.5° | 96.3° |
| C24 | N1 | C1 | H17 | 180.0° | 55.6° |
| C24 | N1 | C1 | H18 | 60.0° | 64.4° |
| C24 | N1 | C1 | H19 | 60.0° | 175.5° |
| N1 | C24 | H20 | H21 | 114.6° | 118.8° |
| C24 | N1 | C2 | H35 | 43.9° | 16.9° |
| C24 | N1 | C2 | H36 | 74.8° | 139.6° |
| N5 | C10 | C11 | C9 | 178.2° | 178.8° |
| N5 | C10 | C11 | C12 | 176.7° | 176.0° |
| N5 | C10 | C9 | C8 | 176.4° | 176.2° |
| N5 | C10 | C9 | H9 | 3.5° | 0.0° |
| N5 | C10 | C11 | H10 | 3.3° | 2.1° |
| C1 | N1 | C2 | C3 | 71.8° | 150.7° |
| N1 | C1 | H17 | H18 | 120.0° | 120.0° |
| N1 | C1 | H17 | H19 | 120.0° | 120.0° |
| N1 | C1 | H18 | H19 | 120.0° | 120.1° |
| C1 | N1 | C24 | H20 | 176.3° | 120.5° |
| C1 | N1 | C24 | H21 | 59.6° | 122.5° |
| C1 | N1 | C2 | H35 | 167.6° | 96.1° |
| C1 | N1 | C2 | H36 | 48.8° | 26.7° |
| C10 | C11 | C12 | H10 | 180.0° | 178.3° |
| C10 | C11 | C12 | C13 | 1.8° | 4.6° |
| C11 | C10 | C9 | C8 | 1.8° | 2.6° |
| C11 | C10 | C9 | H9 | 178.2° | 178.8° |
| C10 | C11 | C12 | H11 | 178.2° | 176.8° |
| C11 | C10 | N5 | H25 | 134.3° | 166.0° |
| C12 | C11 | C10 | C9 | 1.5° | 2.7° |
| C11 | C12 | C13 | H11 | 180.0° | 172.5° |
| C11 | C12 | C13 | C8 | 2.3° | 5.9° |
| C11 | C12 | C13 | N3 | 177.6° | 177.7° |
| N1 | C2 | C3 | H35 | 120.6° | 112.4° |
| N1 | C2 | C3 | H36 | 120.6° | 120.4° |
| N1 | C2 | C3 | C4 | 165.5° | 164.5° |
| C2 | N1 | C1 | H17 | 57.0° | 60.0° |
| C2 | N1 | C1 | H18 | 63.0° | 180.0° |
| C2 | N1 | C1 | H19 | 176.9° | 60.0° |
| C2 | N1 | C24 | H20 | 51.6° | 8.3° |
| C2 | N1 | C24 | H21 | 65.1° | 125.3° |
| N1 | C2 | C3 | H33 | 74.0° | 78.8° |
| N1 | C2 | C3 | H34 | 45.1° | 44.2° |
| N1 | C2 | H35 | H36 | 118.1° | 118.4° |
| C10 | C9 | C8 | H9 | 180.0° | 176.1° |
| C10 | C9 | C8 | C13 | 2.4° | 4.4° |
| C10 | C9 | C8 | O2 | 175.8° | 176.2° |
| C9 | C10 | C11 | H10 | 178.5° | 179.1° |
| C9 | C10 | N5 | H25 | 43.9° | 15.2° |
| C12 | C13 | C8 | C9 | 2.7° | 6.0° |
| C12 | C13 | C8 | N3 | 179.9° | 171.9° |
| C12 | C13 | C8 | O2 | 175.7° | 174.6° |
| C12 | C13 | N3 | C18 | 26.5° | 63.8° |
| C12 | C13 | N3 | C14 | 105.8° | 59.9° |
| C13 | C12 | C11 | H10 | 178.2° | 177.1° |
| C9 | C8 | C13 | O2 | 178.4° | 179.5° |
| C9 | C8 | C13 | N3 | 177.2° | 177.8° |
| C9 | C8 | O2 | C7 | 2.6° | 19.9° |
| C2 | C3 | C4 | H33 | 120.5° | 117.9° |
| C2 | C3 | C4 | H34 | 120.5° | 118.0° |
| C2 | C3 | C4 | N2 | 73.7° | 106.8° |
| C2 | C3 | C4 | H1 | 46.5° | 136.2° |
| C2 | C3 | C4 | H2 | 166.1° | 13.3° |
| C2 | C3 | H33 | H34 | 118.6° | 120.5° |
| C3 | C2 | H35 | H36 | 118.2° | 126.9° |
| C8 | C13 | N3 | C18 | 153.4° | 107.4° |
| C8 | C13 | N3 | C14 | 74.3° | 128.8° |
| C13 | C8 | O2 | C7 | 175.8° | 159.6° |
| C13 | C8 | C9 | H9 | 177.6° | 179.4° |
| C8 | C13 | C12 | H11 | 177.7° | 178.4° |
| N3 | C13 | C8 | O2 | 4.4° | 2.7° |
| C13 | N3 | C18 | C14 | 134.3° | 123.8° |
| C13 | N3 | C18 | C17 | 170.9° | 176.8° |
| C13 | N3 | C14 | C15 | 169.9° | 176.9° |
| N3 | C13 | C12 | H11 | 2.4° | 9.8° |
| C13 | N3 | C14 | H12 | 49.7° | 56.9° |
| C13 | N3 | C14 | H13 | 70.0° | 63.2° |
| C13 | N3 | C18 | H26 | 68.9° | 63.1° |
| C13 | N3 | C18 | H27 | 50.7° | 56.9° |
| C8 | O2 | C7 | C6 | 74.2° | 74.2° |
| C8 | O2 | C7 | H7 | 166.0° | 165.4° |
| C8 | O2 | C7 | H8 | 45.7° | 47.0° |
| O2 | C8 | C9 | H9 | 4.2° | 0.0° |
| N3 | C18 | C17 | H26 | 120.2° | 120.1° |
| N3 | C18 | C17 | H27 | 120.2° | 119.9° |
| N3 | C18 | C17 | N4 | 56.8° | 58.4° |
| C18 | N3 | C14 | C15 | 55.4° | 59.4° |
| C18 | N3 | C14 | H12 | 175.6° | 179.3° |
| C18 | N3 | C14 | H13 | 64.8° | 60.5° |
| N3 | C18 | H26 | H27 | 119.4° | 120.1° |
| N3 | C18 | C17 | H28 | 177.0° | 61.5° |
| N3 | C18 | C17 | H29 | 63.5° | 178.4° |
| C17 | C18 | N3 | C14 | 54.8° | 59.4° |
| C18 | C17 | N4 | H28 | 120.2° | 119.9° |
| C18 | C17 | N4 | H29 | 120.2° | 120.0° |
| C18 | C17 | N4 | C15 | 58.4° | 59.3° |
| C18 | C17 | N4 | C16 | 179.7° | 176.8° |
| C17 | C18 | H26 | H27 | 119.4° | 120.0° |
| C18 | C17 | H28 | H29 | 119.3° | 120.0° |
| C3 | C4 | N2 | C5 | 103.1° | 73.3° |
| C3 | C4 | N2 | H1 | 120.2° | 120.3° |
| C3 | C4 | N2 | H2 | 120.2° | 122.4° |
| C3 | C4 | N2 | C6 | 74.4° | 106.8° |
| C3 | C4 | H1 | H2 | 119.4° | 124.3° |
| C4 | C3 | H33 | H34 | 118.6° | 123.7° |
| C4 | C3 | C2 | H35 | 45.0° | 83.1° |
| C4 | C3 | C2 | H36 | 73.8° | 44.1° |
| N3 | C14 | C15 | H12 | 120.2° | 119.9° |
| N3 | C14 | C15 | H13 | 120.2° | 119.9° |
| N3 | C14 | C15 | N4 | 57.9° | 58.4° |
| N3 | C14 | H12 | H13 | 119.4° | 120.1° |
| N3 | C14 | C15 | H14 | 62.3° | 61.6° |
| N3 | C14 | C15 | H15 | 178.1° | 178.4° |
| C14 | N3 | C18 | H26 | 65.4° | 60.6° |
| C14 | N3 | C18 | H27 | 175.0° | 179.3° |
| O2 | C7 | C6 | H7 | 119.9° | 118.2° |
| O2 | C7 | C6 | H8 | 119.8° | 121.3° |
| O2 | C7 | C6 | N2 | 153.4° | 172.8° |
| O2 | C7 | C6 | O1 | 22.5° | 5.4° |
| O2 | C7 | H7 | H8 | 120.4° | 119.2° |
| C5 | N2 | C6 | C7 | 14.5° | 15.2° |
| C5 | N2 | C4 | C6 | 177.5° | 179.9° |
| C5 | N2 | C6 | O1 | 169.6° | 166.7° |
| C5 | N2 | C4 | H1 | 17.1° | 47.0° |
| C5 | N2 | C4 | H2 | 136.7° | 164.2° |
| N2 | C5 | H3 | H4 | 120.0° | 120.0° |
| N2 | C5 | H3 | H5 | 120.0° | 120.1° |
| N2 | C5 | H4 | H5 | 120.0° | 120.1° |
| C7 | C6 | N2 | C4 | 162.8° | 164.9° |
| C7 | C6 | N2 | O1 | 175.8° | 178.1° |
| C6 | C7 | H7 | H8 | 120.5° | 121.1° |
| C17 | N4 | C15 | C14 | 59.0° | 59.3° |
| C17 | N4 | C15 | C16 | 122.0° | 123.8° |
| C17 | N4 | C15 | H14 | 61.2° | 60.7° |
| C17 | N4 | C15 | H15 | 179.3° | 179.3° |
| N4 | C17 | C18 | H26 | 63.4° | 61.6° |
| N4 | C17 | C18 | H27 | 177.0° | 178.4° |
| N4 | C17 | H28 | H29 | 119.4° | 120.1° |
| C17 | N4 | C16 | H30 | 180.0° | 176.2° |
| C17 | N4 | C16 | H31 | 60.0° | 56.2° |
| C17 | N4 | C16 | H32 | 60.0° | 63.8° |
| C4 | N2 | C6 | O1 | 13.0° | 13.2° |
| N2 | C4 | H1 | H2 | 119.4° | 116.2° |
| C4 | N2 | C5 | H3 | 180.0° | 90.1° |
| C4 | N2 | C5 | H4 | 60.0° | 150.0° |
| C4 | N2 | C5 | H5 | 60.0° | 30.0° |
| N2 | C4 | C3 | H33 | 165.8° | 11.2° |
| N2 | C4 | C3 | H34 | 46.8° | 135.2° |
| C6 | N2 | C4 | H1 | 165.4° | 132.9° |
| C6 | N2 | C4 | H2 | 45.8° | 15.7° |
| C6 | N2 | C5 | H3 | 2.6° | 90.0° |
| C6 | N2 | C5 | H4 | 117.4° | 29.9° |
| C6 | N2 | C5 | H5 | 122.6° | 149.9° |
| N2 | C6 | C7 | H7 | 86.7° | 69.0° |
| N2 | C6 | C7 | H8 | 33.6° | 51.5° |
| O1 | C6 | C7 | H7 | 97.4° | 112.8° |
| O1 | C6 | C7 | H8 | 142.3° | 126.7° |
| C14 | C15 | N4 | H14 | 120.2° | 120.0° |
| C14 | C15 | N4 | H15 | 120.2° | 120.0° |
| C14 | C15 | N4 | C16 | 179.0° | 176.8° |
| C15 | C14 | H12 | H13 | 119.4° | 120.0° |
| C14 | C15 | H14 | H15 | 119.3° | 120.1° |
| N4 | C15 | C14 | H12 | 178.1° | 178.4° |
| N4 | C15 | C14 | H13 | 62.3° | 61.5° |
| N4 | C15 | H14 | H15 | 119.3° | 120.0° |
| C15 | N4 | C17 | H28 | 178.6° | 60.6° |
| C15 | N4 | C17 | H29 | 61.8° | 179.3° |
| C15 | N4 | C16 | H30 | 58.8° | 60.1° |
| C15 | N4 | C16 | H31 | 178.8° | 180.0° |
| C15 | N4 | C16 | H32 | 61.2° | 59.9° |
| C16 | N4 | C15 | H14 | 60.8° | 63.2° |
| C16 | N4 | C15 | H15 | 58.8° | 56.9° |
| C16 | N4 | C17 | H28 | 59.5° | 63.2° |
| C16 | N4 | C17 | H29 | 60.1° | 56.9° |
| N4 | C16 | H30 | H31 | 120.0° | 119.9° |
| N4 | C16 | H30 | H32 | 120.0° | 120.0° |
| N4 | C16 | H31 | H32 | 120.0° | 120.0° |
| H1 | C4 | C3 | H33 | 74.0° | 105.8° |
| H1 | C4 | C3 | H34 | 167.0° | 18.2° |
| H2 | C4 | C3 | H33 | 45.6° | 131.2° |
| H2 | C4 | C3 | H34 | 73.4° | 104.8° |
| H3 | C5 | H4 | H5 | 120.0° | 120.0° |
| H10 | C11 | C12 | H11 | 1.8° | 4.9° |
| H12 | C14 | C15 | H14 | 57.8° | 58.4° |
| H12 | C14 | C15 | H15 | 61.7° | 61.7° |
| H13 | C14 | C15 | H14 | 177.5° | 178.5° |
| H13 | C14 | C15 | H15 | 58.0° | 58.4° |
| H17 | C1 | H18 | H19 | 120.0° | 120.0° |
| H22 | N8 | C22 | H23 | 0.2° | 4.1° |
| H26 | C18 | C17 | H28 | 56.8° | 178.4° |
| H26 | C18 | C17 | H29 | 176.3° | 58.3° |
| H27 | C18 | C17 | H28 | 62.8° | 58.4° |
| H27 | C18 | C17 | H29 | 56.7° | 61.7° |
| H30 | C16 | H31 | H32 | 119.9° | 120.1° |
| H33 | C3 | C2 | H35 | 165.4° | 33.6° |
| H33 | C3 | C2 | H36 | 46.6° | 160.8° |
| H34 | C3 | C2 | H35 | 75.5° | 156.5° |
| H34 | C3 | C2 | H36 | 165.7° | 76.2° |
