I64
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C18 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C60 | C18 | sing | 1.53Å | 1.53Å | |
| O1 | C7 | doub | 1.21Å | 1.22Å | |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | sing | 1.51Å | 1.49Å | |
| C8 | N | sing | 1.46Å | 1.44Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C25 | C30 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C6 | sing | 1.51Å | 1.52Å | |
| C24 | C10 | sing | 1.53Å | 1.53Å | |
| N1 | C9 | sing | 1.35Å | 1.33Å | |
| N1 | C10 | sing | 1.46Å | 1.45Å | |
| O3 | C11 | doub | 1.21Å | 1.21Å | |
| C7 | N | sing | 1.35Å | 1.31Å | |
| C7 | O | sing | 1.35Å | 1.44Å | |
| C9 | O2 | doub | 1.21Å | 1.20Å | |
| C10 | C11 | sing | 1.51Å | 1.50Å | |
| C6 | O | sing | 1.45Å | 1.43Å | |
| C16 | C15 | sing | 1.51Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C11 | N2 | sing | 1.35Å | 1.33Å | |
| C15 | O5 | doub | 1.21Å | 1.22Å | |
| C15 | N3 | sing | 1.35Å | 1.34Å | |
| N2 | N3 | sing | 1.40Å | 1.32Å | |
| N3 | C12 | sing | 1.47Å | 1.46Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.51Å | 1.52Å | |
| N4 | C14 | sing | 1.35Å | 1.34Å | |
| C14 | O4 | doub | 1.21Å | 1.22Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| C | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C35 | H25 | sing | 1.09Å | 1.10Å | |
| C35 | H26 | sing | 1.09Å | 1.10Å | |
| C35 | H27 | sing | 1.09Å | 1.10Å | |
| C4 | H28 | sing | 1.08Å | 1.08Å | |
| C5 | H29 | sing | 1.08Å | 1.08Å | |
| C6 | H30 | sing | 1.09Å | 1.10Å | |
| C6 | H31 | sing | 1.09Å | 1.10Å | |
| C60 | H32 | sing | 1.09Å | 1.10Å | |
| C60 | H33 | sing | 1.09Å | 1.10Å | |
| C60 | H34 | sing | 1.09Å | 1.10Å | |
| C8 | H35 | sing | 1.09Å | 1.10Å | |
| N1 | H36 | sing | 0.97Å | 1.00Å | |
| N2 | H37 | sing | 0.97Å | 1.00Å | |
| N4 | H38 | sing | 0.97Å | 1.00Å | |
| N4 | H39 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 119.8° | 120.0° |
| C1 | C | C5 | 120.1° | 120.0° |
| C1 | C | H2 | 119.9° | 120.0° |
| C | C1 | H3 | 120.1° | 120.0° |
| C1 | C2 | C3 | 120.1° | 120.0° |
| C2 | C1 | H3 | 120.1° | 119.9° |
| C1 | C2 | H15 | 119.9° | 120.1° |
| C | C5 | C4 | 120.4° | 120.0° |
| C5 | C | H2 | 120.0° | 120.0° |
| C | C5 | H29 | 119.8° | 120.0° |
| C35 | C18 | C60 | 112.5° | 109.4° |
| C35 | C18 | C8 | 108.5° | 109.5° |
| C35 | C18 | H14 | 107.6° | 109.5° |
| C18 | C35 | H25 | 109.5° | 109.5° |
| C18 | C35 | H26 | 109.5° | 109.5° |
| C18 | C35 | H27 | 109.4° | 109.5° |
| C2 | C3 | C4 | 119.8° | 120.0° |
| C2 | C3 | C6 | 120.9° | 120.0° |
| C3 | C2 | H15 | 120.0° | 120.0° |
| C26 | C25 | C24 | 112.2° | 109.5° |
| C26 | C25 | C30 | 112.5° | 109.5° |
| C26 | C25 | H18 | 107.2° | 109.5° |
| C25 | C26 | H19 | 109.5° | 109.5° |
| C25 | C26 | H20 | 109.4° | 109.5° |
| C25 | C26 | H21 | 109.5° | 109.5° |
| C60 | C18 | C8 | 112.9° | 109.5° |
| C60 | C18 | H14 | 107.5° | 109.5° |
| C18 | C60 | H32 | 109.5° | 109.5° |
| C18 | C60 | H33 | 109.5° | 109.4° |
| C18 | C60 | H34 | 109.5° | 109.5° |
| O1 | C7 | N | 123.2° | 120.0° |
| O1 | C7 | O | 119.4° | 120.0° |
| C5 | C4 | C3 | 119.7° | 120.0° |
| C5 | C4 | H28 | 120.1° | 120.0° |
| C4 | C5 | H29 | 119.8° | 120.0° |
| C18 | C8 | C9 | 111.7° | 109.5° |
| C18 | C8 | N | 107.7° | 109.5° |
| C8 | C18 | H14 | 107.6° | 109.5° |
| C18 | C8 | H35 | 109.8° | 109.4° |
| C9 | C8 | N | 106.2° | 109.5° |
| C8 | C9 | N1 | 119.0° | 120.0° |
| C8 | C9 | O2 | 118.2° | 120.0° |
| C9 | C8 | H35 | 110.3° | 109.5° |
| C8 | N | C7 | 120.2° | 120.0° |
| C8 | N | H1 | 119.9° | 120.0° |
| N | C8 | H35 | 111.1° | 109.5° |
| C24 | C25 | C30 | 110.1° | 109.4° |
| C25 | C24 | C10 | 112.7° | 109.5° |
| C25 | C24 | H16 | 108.6° | 109.4° |
| C25 | C24 | H17 | 108.6° | 109.5° |
| C24 | C25 | H18 | 107.3° | 109.5° |
| C30 | C25 | H18 | 107.2° | 109.4° |
| C25 | C30 | H22 | 109.5° | 109.4° |
| C25 | C30 | H23 | 109.5° | 109.5° |
| C25 | C30 | H24 | 109.5° | 109.5° |
| C4 | C3 | C6 | 119.3° | 120.0° |
| C3 | C4 | H28 | 120.1° | 120.0° |
| C3 | C6 | O | 112.7° | 109.5° |
| C3 | C6 | H30 | 108.7° | 109.5° |
| C3 | C6 | H31 | 108.6° | 109.5° |
| C24 | C10 | N1 | 111.3° | 109.5° |
| C24 | C10 | C11 | 109.4° | 109.4° |
| C24 | C10 | H4 | 108.9° | 109.4° |
| C10 | C24 | H16 | 108.7° | 109.5° |
| C10 | C24 | H17 | 108.7° | 109.5° |
| C9 | N1 | C10 | 119.3° | 120.0° |
| N1 | C9 | O2 | 122.8° | 120.0° |
| C9 | N1 | H36 | 120.3° | 120.0° |
| N1 | C10 | C11 | 107.8° | 109.5° |
| N1 | C10 | H4 | 110.0° | 109.5° |
| C10 | N1 | H36 | 120.4° | 120.0° |
| O3 | C11 | C10 | 119.1° | 120.0° |
| O3 | C11 | N2 | 123.5° | 120.0° |
| N | C7 | O | 117.4° | 120.0° |
| C7 | N | H1 | 119.9° | 120.0° |
| C7 | O | C6 | 117.7° | 117.0° |
| C10 | C11 | N2 | 117.4° | 120.0° |
| C11 | C10 | H4 | 109.3° | 109.5° |
| O | C6 | H30 | 108.6° | 109.5° |
| O | C6 | H31 | 108.7° | 109.5° |
| C15 | C16 | C17 | 111.2° | 109.5° |
| C16 | C15 | O5 | 117.4° | 120.0° |
| C16 | C15 | N3 | 120.6° | 120.0° |
| C15 | C16 | H9 | 109.0° | 109.5° |
| C15 | C16 | H10 | 109.1° | 109.4° |
| C17 | C16 | H9 | 109.1° | 109.5° |
| C17 | C16 | H10 | 109.0° | 109.5° |
| C16 | C17 | H11 | 109.5° | 109.5° |
| C16 | C17 | H12 | 109.5° | 109.4° |
| C16 | C17 | H13 | 109.5° | 109.5° |
| C11 | N2 | N3 | 120.3° | 120.0° |
| C11 | N2 | H37 | 119.8° | 120.0° |
| O5 | C15 | N3 | 122.0° | 120.0° |
| C15 | N3 | N2 | 118.7° | 120.0° |
| C15 | N3 | C12 | 124.7° | 120.0° |
| N2 | N3 | C12 | 116.5° | 120.0° |
| N3 | N2 | H37 | 119.8° | 119.9° |
| N3 | C12 | C13 | 108.9° | 109.5° |
| N3 | C12 | H5 | 109.6° | 109.4° |
| N3 | C12 | H6 | 109.6° | 109.5° |
| C12 | C13 | C14 | 110.2° | 109.4° |
| C13 | C12 | H5 | 109.6° | 109.5° |
| C13 | C12 | H6 | 109.6° | 109.5° |
| C12 | C13 | H7 | 109.3° | 109.5° |
| C12 | C13 | H8 | 109.3° | 109.5° |
| C13 | C14 | N4 | 119.2° | 119.9° |
| C13 | C14 | O4 | 120.9° | 120.0° |
| C14 | C13 | H7 | 109.3° | 109.4° |
| C14 | C13 | H8 | 109.3° | 109.5° |
| N4 | C14 | O4 | 120.0° | 120.1° |
| C14 | N4 | H38 | 120.0° | 120.0° |
| C14 | N4 | H39 | 120.0° | 119.9° |
| H5 | C12 | H6 | 109.5° | 109.5° |
| H7 | C13 | H8 | 109.5° | 109.5° |
| H9 | C16 | H10 | 109.4° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.5° |
| H11 | C17 | H13 | 109.4° | 109.5° |
| H12 | C17 | H13 | 109.4° | 109.5° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H19 | C26 | H20 | 109.5° | 109.4° |
| H19 | C26 | H21 | 109.5° | 109.5° |
| H20 | C26 | H21 | 109.5° | 109.5° |
| H22 | C30 | H23 | 109.4° | 109.5° |
| H22 | C30 | H24 | 109.4° | 109.5° |
| H23 | C30 | H24 | 109.5° | 109.5° |
| H25 | C35 | H26 | 109.4° | 109.4° |
| H25 | C35 | H27 | 109.5° | 109.5° |
| H26 | C35 | H27 | 109.5° | 109.4° |
| H30 | C6 | H31 | 109.5° | 109.5° |
| H32 | C60 | H33 | 109.4° | 109.5° |
| H32 | C60 | H34 | 109.4° | 109.5° |
| H33 | C60 | H34 | 109.5° | 109.5° |
| H38 | N4 | H39 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | H3 | 180.0° | 180.0° |
| C1 | C | C5 | H2 | 180.0° | 179.7° |
| C | C1 | C2 | C3 | 0.1° | 0.0° |
| C1 | C | C5 | C4 | 0.4° | 0.0° |
| C | C1 | C2 | H15 | 179.8° | 180.0° |
| C1 | C | C5 | H29 | 179.6° | 179.7° |
| C2 | C1 | C | C5 | 0.3° | 0.0° |
| C1 | C2 | C3 | H15 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.5° | 0.0° |
| C1 | C2 | C3 | C6 | 178.9° | 179.9° |
| C2 | C1 | C | H2 | 179.6° | 179.8° |
| C | C5 | C4 | H29 | 180.0° | 179.7° |
| C | C5 | C4 | C3 | 0.0° | 0.0° |
| C5 | C | C1 | H3 | 179.7° | 180.0° |
| C | C5 | C4 | H28 | 180.0° | 180.0° |
| C35 | C18 | C60 | C8 | 123.1° | 120.0° |
| C35 | C18 | C60 | H14 | 118.3° | 120.0° |
| C35 | C18 | C8 | H14 | 116.1° | 120.0° |
| C35 | C18 | C8 | C9 | 170.2° | 174.8° |
| C35 | C18 | C8 | N | 73.6° | 65.1° |
| C18 | C35 | H25 | H26 | 120.0° | 120.1° |
| C18 | C35 | H25 | H27 | 120.0° | 120.0° |
| C18 | C35 | H26 | H27 | 120.0° | 120.0° |
| C35 | C18 | C60 | H32 | 180.0° | 60.6° |
| C35 | C18 | C60 | H33 | 60.0° | 179.4° |
| C35 | C18 | C60 | H34 | 60.0° | 59.4° |
| C35 | C18 | C8 | H35 | 47.5° | 54.8° |
| C2 | C3 | C4 | C5 | 0.5° | 0.0° |
| C2 | C3 | C4 | C6 | 178.4° | 179.9° |
| C2 | C3 | C6 | O | 101.0° | 90.0° |
| C3 | C2 | C1 | H3 | 179.9° | 180.0° |
| C2 | C3 | C4 | H28 | 179.5° | 180.0° |
| C2 | C3 | C6 | H30 | 138.5° | 30.0° |
| C2 | C3 | C6 | H31 | 19.5° | 150.0° |
| C26 | C25 | C24 | C30 | 126.2° | 120.0° |
| C26 | C25 | C24 | H18 | 117.5° | 120.0° |
| C26 | C25 | C30 | H18 | 117.6° | 120.0° |
| C26 | C25 | C24 | C10 | 74.7° | 175.0° |
| C26 | C25 | C24 | H16 | 164.8° | 55.0° |
| C26 | C25 | C24 | H17 | 45.8° | 65.0° |
| C25 | C26 | H19 | H20 | 120.0° | 120.0° |
| C25 | C26 | H19 | H21 | 120.0° | 120.0° |
| C25 | C26 | H20 | H21 | 120.0° | 120.0° |
| C26 | C25 | C30 | H22 | 180.0° | 60.0° |
| C26 | C25 | C30 | H23 | 60.0° | 180.0° |
| C26 | C25 | C30 | H24 | 60.0° | 60.0° |
| C60 | C18 | C8 | H14 | 118.5° | 120.0° |
| C60 | C18 | C8 | C9 | 44.8° | 65.3° |
| C60 | C18 | C8 | N | 161.0° | 54.8° |
| C60 | C18 | C35 | H25 | 180.0° | 60.0° |
| C60 | C18 | C35 | H26 | 60.0° | 60.0° |
| C60 | C18 | C35 | H27 | 60.0° | 180.0° |
| C18 | C60 | H32 | H33 | 120.0° | 119.9° |
| C18 | C60 | H32 | H34 | 120.0° | 120.1° |
| C18 | C60 | H33 | H34 | 120.0° | 120.0° |
| C60 | C18 | C8 | H35 | 77.9° | 174.7° |
| O1 | C7 | N | C8 | 1.9° | 0.2° |
| O1 | C7 | N | O | 179.3° | 180.0° |
| O1 | C7 | O | C6 | 5.7° | 0.0° |
| O1 | C7 | N | H1 | 178.1° | 180.0° |
| C5 | C4 | C3 | H28 | 180.0° | 180.0° |
| C5 | C4 | C3 | C6 | 178.9° | 180.0° |
| C4 | C5 | C | H2 | 179.6° | 179.7° |
| C18 | C8 | C9 | N | 117.1° | 120.0° |
| C18 | C8 | C9 | H35 | 122.4° | 119.9° |
| C18 | C8 | N | H35 | 120.3° | 119.9° |
| C18 | C8 | C9 | N1 | 107.6° | 81.5° |
| C18 | C8 | N | C7 | 126.9° | 84.7° |
| C18 | C8 | C9 | O2 | 72.7° | 98.5° |
| C18 | C8 | N | H1 | 53.1° | 95.1° |
| C8 | C18 | C35 | H25 | 54.4° | 60.0° |
| C8 | C18 | C35 | H26 | 174.4° | 180.0° |
| C8 | C18 | C35 | H27 | 65.6° | 60.1° |
| C8 | C18 | C60 | H32 | 56.9° | 59.3° |
| C8 | C18 | C60 | H33 | 63.1° | 60.6° |
| C8 | C18 | C60 | H34 | 176.8° | 179.4° |
| C9 | C8 | N | H35 | 120.0° | 120.0° |
| C8 | C9 | N1 | O2 | 179.6° | 179.9° |
| C8 | C9 | N1 | C10 | 177.0° | 176.1° |
| C9 | C8 | N | C7 | 113.3° | 155.2° |
| C9 | C8 | N | H1 | 66.7° | 25.0° |
| C9 | C8 | C18 | H14 | 73.7° | 54.8° |
| C8 | C9 | N1 | H36 | 3.0° | 4.0° |
| N | C8 | C9 | N1 | 135.2° | 158.5° |
| C8 | N | C7 | H1 | 180.0° | 179.8° |
| C8 | N | C7 | O | 178.7° | 179.8° |
| N | C8 | C9 | O2 | 44.4° | 21.6° |
| N | C8 | C18 | H14 | 42.5° | 174.8° |
| C24 | C25 | C30 | H18 | 116.4° | 120.0° |
| C25 | C24 | C10 | H16 | 120.5° | 119.9° |
| C25 | C24 | C10 | H17 | 120.5° | 120.0° |
| C25 | C24 | C10 | N1 | 73.2° | 65.0° |
| C25 | C24 | C10 | C11 | 167.8° | 175.0° |
| C25 | C24 | C10 | H4 | 48.3° | 55.0° |
| C25 | C24 | H16 | H17 | 118.5° | 120.0° |
| C24 | C25 | C26 | H19 | 180.0° | 60.0° |
| C24 | C25 | C26 | H20 | 60.0° | 180.0° |
| C24 | C25 | C26 | H21 | 60.0° | 60.0° |
| C24 | C25 | C30 | H22 | 54.0° | 60.0° |
| C24 | C25 | C30 | H23 | 66.0° | 60.0° |
| C24 | C25 | C30 | H24 | 174.0° | 180.0° |
| C30 | C25 | C24 | C10 | 51.4° | 65.0° |
| C30 | C25 | C24 | H16 | 69.1° | 175.0° |
| C30 | C25 | C24 | H17 | 171.9° | 55.0° |
| C30 | C25 | C26 | H19 | 55.1° | 60.0° |
| C30 | C25 | C26 | H20 | 64.9° | 60.0° |
| C30 | C25 | C26 | H21 | 175.1° | 180.0° |
| C25 | C30 | H22 | H23 | 120.0° | 120.0° |
| C25 | C30 | H22 | H24 | 120.0° | 120.0° |
| C25 | C30 | H23 | H24 | 120.0° | 120.0° |
| C4 | C3 | C6 | O | 80.6° | 90.0° |
| C4 | C3 | C2 | H15 | 179.4° | 179.9° |
| C3 | C4 | C5 | H29 | 180.0° | 179.8° |
| C4 | C3 | C6 | H30 | 39.9° | 150.0° |
| C4 | C3 | C6 | H31 | 158.9° | 30.0° |
| C3 | C6 | O | C7 | 75.9° | 180.0° |
| C3 | C6 | O | H30 | 120.5° | 120.0° |
| C3 | C6 | O | H31 | 120.5° | 120.0° |
| C6 | C3 | C2 | H15 | 1.0° | 0.0° |
| C6 | C3 | C4 | H28 | 1.1° | 0.1° |
| C3 | C6 | H30 | H31 | 118.5° | 120.0° |
| C24 | C10 | N1 | C9 | 169.6° | 85.0° |
| C24 | C10 | N1 | C11 | 120.0° | 120.0° |
| C24 | C10 | N1 | H4 | 120.8° | 120.0° |
| C24 | C10 | C11 | O3 | 95.5° | 120.0° |
| C24 | C10 | C11 | H4 | 119.2° | 119.9° |
| C24 | C10 | C11 | N2 | 84.3° | 60.0° |
| C10 | C24 | H16 | H17 | 118.5° | 120.0° |
| C10 | C24 | C25 | H18 | 167.8° | 55.0° |
| C24 | C10 | N1 | H36 | 10.3° | 95.0° |
| C9 | N1 | C10 | H36 | 180.0° | 179.9° |
| C9 | N1 | C10 | C11 | 70.4° | 155.1° |
| C9 | N1 | C10 | H4 | 48.8° | 35.0° |
| N1 | C9 | C8 | H35 | 14.8° | 38.5° |
| N1 | C10 | C11 | O3 | 25.8° | 0.0° |
| C10 | N1 | C9 | O2 | 2.6° | 3.9° |
| N1 | C10 | C11 | H4 | 119.6° | 120.0° |
| N1 | C10 | C11 | N2 | 154.5° | 180.0° |
| N1 | C10 | C24 | H16 | 166.4° | 55.0° |
| N1 | C10 | C24 | H17 | 47.3° | 175.0° |
| O3 | C11 | C10 | N2 | 179.8° | 180.0° |
| O3 | C11 | N2 | N3 | 1.0° | 0.0° |
| O3 | C11 | C10 | H4 | 145.3° | 120.0° |
| O3 | C11 | N2 | H37 | 179.0° | 180.0° |
| N | C7 | O | C6 | 173.7° | 180.0° |
| C7 | N | C8 | H35 | 6.6° | 35.2° |
| O | C7 | N | H1 | 1.3° | 0.1° |
| C7 | O | C6 | H30 | 163.6° | 60.0° |
| C7 | O | C6 | H31 | 44.5° | 60.0° |
| O2 | C9 | C8 | H35 | 164.8° | 141.6° |
| O2 | C9 | N1 | H36 | 177.4° | 176.1° |
| C10 | C11 | N2 | N3 | 179.2° | 180.0° |
| C11 | C10 | C24 | H16 | 47.3° | 65.0° |
| C11 | C10 | C24 | H17 | 71.7° | 55.0° |
| C11 | C10 | N1 | H36 | 109.7° | 25.0° |
| C10 | C11 | N2 | H37 | 0.8° | 0.0° |
| O | C6 | H30 | H31 | 118.6° | 120.0° |
| C15 | C16 | C17 | H9 | 120.3° | 120.0° |
| C15 | C16 | C17 | H10 | 120.3° | 119.9° |
| C16 | C15 | O5 | N3 | 179.2° | 179.9° |
| C16 | C15 | N3 | N2 | 9.5° | 0.0° |
| C16 | C15 | N3 | C12 | 171.3° | 179.9° |
| C15 | C16 | H9 | H10 | 119.2° | 120.0° |
| C15 | C16 | C17 | H11 | 180.0° | 180.0° |
| C15 | C16 | C17 | H12 | 60.0° | 60.0° |
| C15 | C16 | C17 | H13 | 60.0° | 60.0° |
| C17 | C16 | C15 | O5 | 114.3° | 0.0° |
| C17 | C16 | C15 | N3 | 66.6° | 180.0° |
| C17 | C16 | H9 | H10 | 119.2° | 120.0° |
| C16 | C17 | H11 | H12 | 120.0° | 120.0° |
| C16 | C17 | H11 | H13 | 120.0° | 120.0° |
| C16 | C17 | H12 | H13 | 120.0° | 120.0° |
| C11 | N2 | N3 | C15 | 85.4° | 75.0° |
| C11 | N2 | N3 | H37 | 180.0° | 180.0° |
| C11 | N2 | N3 | C12 | 93.9° | 105.0° |
| N2 | C11 | C10 | H4 | 34.9° | 60.0° |
| O5 | C15 | N3 | N2 | 169.7° | 179.9° |
| O5 | C15 | N3 | C12 | 9.6° | 0.0° |
| O5 | C15 | C16 | H9 | 125.5° | 120.0° |
| O5 | C15 | C16 | H10 | 6.0° | 120.0° |
| C15 | N3 | N2 | C12 | 179.3° | 179.9° |
| C15 | N3 | C12 | C13 | 89.4° | 85.0° |
| C15 | N3 | C12 | H5 | 150.7° | 155.0° |
| C15 | N3 | C12 | H6 | 30.6° | 35.0° |
| N3 | C15 | C16 | H9 | 53.7° | 60.0° |
| N3 | C15 | C16 | H10 | 173.2° | 60.0° |
| C15 | N3 | N2 | H37 | 94.6° | 105.0° |
| N2 | N3 | C12 | C13 | 89.9° | 94.9° |
| N2 | N3 | C12 | H5 | 30.0° | 25.1° |
| N2 | N3 | C12 | H6 | 150.2° | 145.0° |
| N3 | C12 | C13 | H5 | 119.9° | 120.0° |
| N3 | C12 | C13 | H6 | 119.9° | 120.0° |
| N3 | C12 | C13 | C14 | 176.3° | 180.0° |
| N3 | C12 | H5 | H6 | 120.2° | 120.0° |
| N3 | C12 | C13 | H7 | 56.2° | 60.0° |
| N3 | C12 | C13 | H8 | 63.6° | 60.1° |
| C12 | N3 | N2 | H37 | 86.1° | 75.0° |
| C12 | C13 | C14 | H7 | 120.1° | 120.0° |
| C12 | C13 | C14 | H8 | 120.1° | 120.0° |
| C12 | C13 | C14 | N4 | 162.0° | 180.0° |
| C12 | C13 | C14 | O4 | 17.7° | 0.0° |
| C13 | C12 | H5 | H6 | 120.3° | 120.0° |
| C12 | C13 | H7 | H8 | 119.7° | 120.0° |
| C13 | C14 | N4 | O4 | 179.7° | 180.0° |
| C14 | C13 | C12 | H5 | 63.7° | 60.0° |
| C14 | C13 | C12 | H6 | 56.4° | 60.0° |
| C14 | C13 | H7 | H8 | 119.7° | 120.0° |
| C13 | C14 | N4 | H38 | 179.7° | 0.0° |
| C13 | C14 | N4 | H39 | 0.3° | 180.0° |
| N4 | C14 | C13 | H7 | 41.9° | 60.0° |
| N4 | C14 | C13 | H8 | 77.9° | 60.0° |
| C14 | N4 | H38 | H39 | 180.0° | 180.0° |
| O4 | C14 | C13 | H7 | 137.8° | 120.0° |
| O4 | C14 | C13 | H8 | 102.4° | 120.0° |
| O4 | C14 | N4 | H38 | 0.0° | 180.0° |
| O4 | C14 | N4 | H39 | 180.0° | 0.0° |
| H1 | N | C8 | H35 | 173.4° | 145.0° |
| H2 | C | C1 | H3 | 0.3° | 0.3° |
| H2 | C | C5 | H29 | 0.4° | 0.0° |
| H3 | C1 | C2 | H15 | 0.2° | 0.0° |
| H4 | C10 | C24 | H16 | 72.2° | 175.0° |
| H4 | C10 | C24 | H17 | 168.8° | 65.0° |
| H4 | C10 | N1 | H36 | 131.2° | 145.0° |
| H5 | C12 | C13 | H7 | 176.1° | 59.9° |
| H5 | C12 | C13 | H8 | 56.4° | 180.0° |
| H6 | C12 | C13 | H7 | 63.7° | 179.9° |
| H6 | C12 | C13 | H8 | 176.5° | 60.0° |
| H9 | C16 | C17 | H11 | 59.7° | 60.0° |
| H9 | C16 | C17 | H12 | 179.8° | 180.0° |
| H9 | C16 | C17 | H13 | 60.3° | 60.0° |
| H10 | C16 | C17 | H11 | 59.7° | 60.0° |
| H10 | C16 | C17 | H12 | 60.3° | 60.0° |
| H10 | C16 | C17 | H13 | 179.7° | 179.9° |
| H11 | C17 | H12 | H13 | 120.0° | 120.0° |
| H14 | C18 | C35 | H25 | 61.8° | 180.0° |
| H14 | C18 | C35 | H26 | 58.2° | 60.0° |
| H14 | C18 | C35 | H27 | 178.2° | 59.9° |
| H14 | C18 | C60 | H32 | 61.7° | 179.3° |
| H14 | C18 | C60 | H33 | 178.3° | 59.4° |
| H14 | C18 | C60 | H34 | 58.2° | 60.6° |
| H14 | C18 | C8 | H35 | 163.6° | 65.2° |
| H16 | C24 | C25 | H18 | 47.3° | 65.0° |
| H17 | C24 | C25 | H18 | 71.7° | 175.0° |
| H18 | C25 | C26 | H19 | 62.5° | 180.0° |
| H18 | C25 | C26 | H20 | 177.5° | 60.0° |
| H18 | C25 | C26 | H21 | 57.5° | 60.1° |
| H18 | C25 | C30 | H22 | 62.4° | 180.0° |
| H18 | C25 | C30 | H23 | 177.6° | 60.0° |
| H18 | C25 | C30 | H24 | 57.6° | 60.0° |
| H19 | C26 | H20 | H21 | 120.0° | 120.0° |
| H22 | C30 | H23 | H24 | 119.9° | 120.0° |
| H25 | C35 | H26 | H27 | 120.0° | 119.9° |
| H28 | C4 | C5 | H29 | 0.0° | 0.2° |
| H32 | C60 | H33 | H34 | 119.9° | 120.0° |
