CJT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N3 | C8 | doub | 1.31Å | 1.33Å | Aromatic |
| N3 | C9 | sing | 1.33Å | 1.35Å | Aromatic |
| C8 | N2 | sing | 1.32Å | 1.34Å | Aromatic |
| N4 | C9 | sing | 1.37Å | 1.36Å | Aromatic |
| N4 | C12 | sing | 1.37Å | 1.37Å | Aromatic |
| C9 | C10 | doub | 1.41Å | 1.42Å | Aromatic |
| N2 | C7 | doub | 1.33Å | 1.34Å | Aromatic |
| C12 | C11 | doub | 1.34Å | 1.36Å | Aromatic |
| C10 | C7 | sing | 1.40Å | 1.44Å | Aromatic |
| C10 | C11 | sing | 1.46Å | 1.44Å | Aromatic |
| C7 | N1 | sing | 1.38Å | 1.36Å | |
| C11 | C13 | sing | 1.51Å | 1.50Å | |
| N1 | C4 | sing | 1.46Å | 1.46Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C13 | C18 | sing | 1.53Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C6 | C1 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C20 | N | sing | 1.47Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C1 | N | sing | 1.47Å | 1.54Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C19 | sing | 1.51Å | 1.52Å | |
| N | C | sing | 1.47Å | 1.46Å | |
| C19 | N5 | sing | 1.35Å | 1.33Å | |
| C19 | O | doub | 1.21Å | 1.24Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| N5 | H17 | sing | 0.97Å | 1.00Å | |
| N5 | H18 | sing | 0.97Å | 1.00Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| N4 | H23 | sing | 0.97Å | 1.00Å | |
| N1 | H24 | sing | 0.97Å | 1.00Å | |
| C4 | H25 | sing | 1.09Å | 1.10Å | |
| C5 | H26 | sing | 1.09Å | 1.10Å | |
| C5 | H27 | sing | 1.09Å | 1.10Å | |
| C6 | H28 | sing | 1.09Å | 1.10Å | |
| C6 | H29 | sing | 1.09Å | 1.10Å | |
| C | H31 | sing | 1.09Å | 1.10Å | |
| C | H32 | sing | 1.09Å | 1.10Å | |
| C | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | N3 | C9 | 113.9° | 120.7° |
| N3 | C8 | N2 | 128.4° | 122.7° |
| N3 | C8 | H6 | 115.8° | 118.7° |
| N3 | C9 | N4 | 126.1° | 134.3° |
| N3 | C9 | C10 | 125.3° | 118.5° |
| C8 | N2 | C7 | 117.0° | 121.1° |
| N2 | C8 | H6 | 115.8° | 118.6° |
| C9 | N4 | C12 | 108.6° | 110.0° |
| N4 | C9 | C10 | 108.5° | 107.1° |
| C9 | N4 | H23 | 125.7° | 124.9° |
| N4 | C12 | C11 | 110.6° | 109.8° |
| N4 | C12 | H7 | 124.7° | 125.0° |
| C12 | N4 | H23 | 125.8° | 125.0° |
| C9 | C10 | C7 | 113.2° | 118.7° |
| C9 | C10 | C11 | 105.8° | 106.2° |
| N2 | C7 | C10 | 121.9° | 118.2° |
| N2 | C7 | N1 | 117.1° | 120.9° |
| C12 | C11 | C10 | 106.4° | 106.8° |
| C12 | C11 | C13 | 126.7° | 126.6° |
| C11 | C12 | H7 | 124.7° | 125.1° |
| C7 | C10 | C11 | 140.8° | 135.1° |
| C10 | C7 | N1 | 121.0° | 120.9° |
| C10 | C11 | C13 | 126.7° | 126.6° |
| C7 | N1 | C4 | 125.3° | 120.0° |
| C7 | N1 | H24 | 105.4° | 120.0° |
| C11 | C13 | C14 | 111.0° | 109.4° |
| C11 | C13 | C18 | 111.8° | 109.5° |
| C11 | C13 | H8 | 108.4° | 109.5° |
| N1 | C4 | C5 | 110.0° | 109.5° |
| N1 | C4 | C3 | 112.6° | 109.5° |
| C4 | N1 | H24 | 105.4° | 120.0° |
| N1 | C4 | H25 | 108.4° | 109.5° |
| C5 | C4 | C3 | 110.5° | 109.4° |
| C4 | C5 | C6 | 111.8° | 109.5° |
| C5 | C4 | H25 | 107.6° | 109.4° |
| C4 | C5 | H26 | 108.9° | 109.5° |
| C4 | C5 | H27 | 108.9° | 109.4° |
| C4 | C3 | C2 | 111.4° | 109.5° |
| C4 | C3 | H4 | 109.0° | 109.4° |
| C4 | C3 | H5 | 109.0° | 109.4° |
| C3 | C4 | H25 | 107.6° | 109.5° |
| C14 | C13 | C18 | 109.8° | 109.4° |
| C13 | C14 | C15 | 111.5° | 109.5° |
| C14 | C13 | H8 | 107.9° | 109.5° |
| C13 | C14 | H9 | 109.0° | 109.5° |
| C13 | C14 | H10 | 108.9° | 109.5° |
| C13 | C18 | C17 | 111.3° | 109.4° |
| C18 | C13 | H8 | 107.9° | 109.5° |
| C13 | C18 | H21 | 109.0° | 109.5° |
| C13 | C18 | H22 | 109.0° | 109.5° |
| C14 | C15 | C16 | 110.6° | 109.5° |
| C15 | C14 | H9 | 109.0° | 109.5° |
| C15 | C14 | H10 | 109.0° | 109.5° |
| C14 | C15 | H11 | 109.2° | 109.5° |
| C14 | C15 | H12 | 109.2° | 109.5° |
| C5 | C6 | C1 | 110.7° | 109.5° |
| C6 | C5 | H26 | 108.9° | 109.5° |
| C6 | C5 | H27 | 108.9° | 109.5° |
| C5 | C6 | H28 | 109.2° | 109.4° |
| C5 | C6 | H29 | 109.2° | 109.5° |
| C18 | C17 | C16 | 110.4° | 109.4° |
| C18 | C17 | H19 | 109.2° | 109.5° |
| C18 | C17 | H20 | 109.3° | 109.5° |
| C17 | C18 | H21 | 109.0° | 109.4° |
| C17 | C18 | H22 | 109.0° | 109.5° |
| C6 | C1 | C2 | 112.5° | 109.5° |
| C6 | C1 | N | 109.2° | 109.5° |
| C6 | C1 | H1 | 106.1° | 109.5° |
| C1 | C6 | H28 | 109.2° | 109.5° |
| C1 | C6 | H29 | 109.2° | 109.5° |
| C3 | C2 | C1 | 112.8° | 109.5° |
| C3 | C2 | H2 | 108.6° | 109.5° |
| C3 | C2 | H3 | 108.6° | 109.5° |
| C2 | C3 | H4 | 109.0° | 109.5° |
| C2 | C3 | H5 | 109.0° | 109.5° |
| C20 | N | C1 | 115.0° | 111.0° |
| C20 | N | C | 111.6° | 111.0° |
| N | C20 | H14 | 109.5° | 109.5° |
| N | C20 | H15 | 109.5° | 109.5° |
| N | C20 | H16 | 109.5° | 109.5° |
| C2 | C1 | N | 116.4° | 109.4° |
| C2 | C1 | H1 | 106.0° | 109.4° |
| C1 | C2 | H2 | 108.6° | 109.5° |
| C1 | C2 | H3 | 108.6° | 109.5° |
| C15 | C16 | C17 | 109.4° | 109.5° |
| C15 | C16 | C19 | 111.9° | 109.5° |
| C16 | C15 | H11 | 109.2° | 109.5° |
| C16 | C15 | H12 | 109.2° | 109.5° |
| C15 | C16 | H13 | 108.0° | 109.5° |
| C1 | N | C | 114.0° | 111.0° |
| N | C1 | H1 | 105.9° | 109.5° |
| C17 | C16 | C19 | 111.2° | 109.4° |
| C17 | C16 | H13 | 108.0° | 109.5° |
| C16 | C17 | H19 | 109.3° | 109.5° |
| C16 | C17 | H20 | 109.2° | 109.5° |
| C16 | C19 | N5 | 115.8° | 120.0° |
| C16 | C19 | O | 121.2° | 120.0° |
| C19 | C16 | H13 | 108.2° | 109.5° |
| N | C | H31 | 109.5° | 109.5° |
| N | C | H32 | 109.5° | 109.5° |
| N | C | H33 | 109.5° | 109.4° |
| N5 | C19 | O | 123.0° | 120.0° |
| C19 | N5 | H17 | 120.0° | 120.0° |
| C19 | N5 | H18 | 120.0° | 120.0° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H9 | C14 | H10 | 109.5° | 109.4° |
| H11 | C15 | H12 | 109.4° | 109.4° |
| H14 | C20 | H15 | 109.5° | 109.4° |
| H14 | C20 | H16 | 109.4° | 109.5° |
| H15 | C20 | H16 | 109.5° | 109.4° |
| H17 | N5 | H18 | 120.0° | 120.0° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.4° |
| H26 | C5 | H27 | 109.4° | 109.5° |
| H28 | C6 | H29 | 109.5° | 109.5° |
| H31 | C | H32 | 109.4° | 109.5° |
| H31 | C | H33 | 109.5° | 109.5° |
| H32 | C | H33 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | C8 | N2 | H6 | 180.0° | 180.0° |
| C8 | N3 | C9 | N4 | 177.9° | 179.7° |
| C8 | N3 | C9 | C10 | 4.2° | 0.2° |
| N3 | C8 | N2 | C7 | 3.1° | 0.1° |
| C9 | N3 | C8 | N2 | 3.4° | 0.3° |
| N3 | C9 | N4 | C10 | 178.1° | 180.0° |
| N3 | C9 | N4 | C12 | 176.6° | 180.0° |
| N3 | C9 | C10 | C7 | 4.5° | 0.0° |
| N3 | C9 | C10 | C11 | 179.4° | 180.0° |
| C9 | N3 | C8 | H6 | 176.6° | 179.7° |
| N3 | C9 | N4 | H23 | 3.4° | 0.1° |
| C8 | N2 | C7 | C10 | 3.2° | 0.2° |
| C8 | N2 | C7 | N1 | 178.5° | 180.0° |
| C9 | N4 | C12 | H23 | 180.0° | 179.9° |
| C9 | N4 | C12 | C11 | 4.0° | 0.1° |
| N4 | C9 | C10 | C7 | 177.3° | 180.0° |
| N4 | C9 | C10 | C11 | 1.2° | 0.0° |
| C9 | N4 | C12 | H7 | 176.0° | 180.0° |
| C12 | N4 | C9 | C10 | 1.6° | 0.0° |
| N4 | C12 | C11 | H7 | 180.0° | 179.9° |
| N4 | C12 | C11 | C10 | 4.7° | 0.1° |
| N4 | C12 | C11 | C13 | 179.7° | 180.0° |
| C9 | C10 | C7 | N2 | 3.8° | 0.3° |
| C9 | C10 | C11 | C12 | 3.5° | 0.1° |
| C9 | C10 | C7 | C11 | 174.1° | 179.9° |
| C9 | C10 | C7 | N1 | 178.0° | 179.9° |
| C9 | C10 | C11 | C13 | 178.6° | 180.0° |
| C10 | C9 | N4 | H23 | 178.4° | 179.9° |
| N2 | C7 | C10 | N1 | 178.2° | 179.8° |
| N2 | C7 | C10 | C11 | 177.9° | 179.8° |
| N2 | C7 | N1 | C4 | 7.9° | 5.6° |
| C7 | N2 | C8 | H6 | 176.9° | 179.9° |
| N2 | C7 | N1 | H24 | 130.0° | 174.4° |
| C12 | C11 | C10 | C7 | 177.9° | 180.0° |
| C12 | C11 | C10 | C13 | 175.0° | 180.0° |
| C12 | C11 | C13 | C14 | 94.9° | 65.4° |
| C12 | C11 | C13 | C18 | 28.1° | 54.6° |
| C12 | C11 | C13 | H8 | 146.8° | 174.6° |
| C11 | C12 | N4 | H23 | 176.0° | 179.9° |
| C7 | C10 | C11 | C13 | 7.1° | 0.0° |
| C10 | C7 | N1 | C4 | 173.8° | 174.6° |
| C10 | C7 | N1 | H24 | 51.7° | 5.4° |
| C11 | C10 | C7 | N1 | 3.9° | 0.0° |
| C10 | C11 | C13 | C14 | 79.1° | 114.7° |
| C10 | C11 | C13 | C18 | 157.9° | 125.4° |
| C10 | C11 | C12 | H7 | 175.4° | 180.0° |
| C10 | C11 | C13 | H8 | 39.2° | 5.4° |
| C7 | N1 | C4 | H24 | 122.1° | 180.0° |
| C7 | N1 | C4 | C5 | 86.4° | 155.0° |
| C7 | N1 | C4 | C3 | 149.9° | 85.0° |
| C7 | N1 | C4 | H25 | 31.0° | 35.0° |
| C11 | C13 | C14 | C18 | 124.1° | 119.9° |
| C11 | C13 | C14 | H8 | 118.6° | 120.0° |
| C11 | C13 | C18 | H8 | 119.0° | 120.0° |
| C11 | C13 | C14 | C15 | 178.8° | 180.0° |
| C11 | C13 | C18 | C17 | 179.3° | 180.0° |
| C13 | C11 | C12 | H7 | 0.3° | 0.1° |
| C11 | C13 | C14 | H9 | 58.5° | 60.0° |
| C11 | C13 | C14 | H10 | 60.9° | 60.0° |
| C11 | C13 | C18 | H21 | 60.4° | 60.0° |
| C11 | C13 | C18 | H22 | 59.1° | 60.0° |
| N1 | C4 | C5 | C3 | 124.9° | 120.0° |
| N1 | C4 | C5 | H25 | 117.9° | 120.0° |
| N1 | C4 | C3 | H25 | 119.4° | 120.0° |
| N1 | C4 | C5 | C6 | 176.2° | 180.0° |
| N1 | C4 | C3 | C2 | 179.0° | 180.0° |
| N1 | C4 | C3 | H4 | 58.8° | 60.0° |
| N1 | C4 | C3 | H5 | 60.7° | 60.0° |
| N1 | C4 | C5 | H26 | 55.8° | 60.0° |
| N1 | C4 | C5 | H27 | 63.4° | 60.0° |
| C5 | C4 | C3 | H25 | 117.2° | 119.9° |
| C4 | C5 | C6 | H26 | 120.4° | 120.0° |
| C4 | C5 | C6 | H27 | 120.4° | 120.0° |
| C4 | C5 | C6 | C1 | 56.7° | 60.0° |
| C5 | C4 | C3 | C2 | 55.6° | 60.0° |
| C5 | C4 | C3 | H4 | 64.7° | 180.0° |
| C5 | C4 | C3 | H5 | 175.9° | 60.0° |
| C5 | C4 | N1 | H24 | 35.7° | 25.0° |
| C4 | C5 | H26 | H27 | 118.9° | 119.9° |
| C4 | C5 | C6 | H28 | 63.4° | 180.0° |
| C4 | C5 | C6 | H29 | 176.9° | 60.0° |
| C3 | C4 | C5 | C6 | 58.9° | 60.0° |
| C4 | C3 | C2 | H4 | 120.3° | 120.0° |
| C4 | C3 | C2 | H5 | 120.3° | 120.0° |
| C4 | C3 | C2 | C1 | 51.8° | 60.0° |
| C4 | C3 | C2 | H2 | 172.3° | 60.0° |
| C4 | C3 | C2 | H3 | 68.7° | 180.0° |
| C4 | C3 | H4 | H5 | 119.1° | 119.9° |
| C3 | C4 | N1 | H24 | 87.9° | 95.0° |
| C3 | C4 | C5 | H26 | 179.3° | 180.0° |
| C3 | C4 | C5 | H27 | 61.5° | 60.0° |
| C14 | C13 | C18 | H8 | 117.3° | 120.1° |
| C13 | C14 | C15 | H9 | 120.3° | 120.0° |
| C13 | C14 | C15 | H10 | 120.3° | 120.0° |
| C14 | C13 | C18 | C17 | 55.6° | 60.1° |
| C13 | C14 | C15 | C16 | 57.0° | 60.0° |
| C13 | C14 | H9 | H10 | 119.0° | 120.0° |
| C13 | C14 | C15 | H11 | 177.2° | 180.0° |
| C13 | C14 | C15 | H12 | 63.2° | 60.0° |
| C14 | C13 | C18 | H21 | 175.9° | 180.0° |
| C14 | C13 | C18 | H22 | 64.6° | 60.0° |
| C18 | C13 | C14 | C15 | 54.7° | 60.0° |
| C13 | C18 | C17 | H21 | 120.3° | 120.0° |
| C13 | C18 | C17 | H22 | 120.3° | 120.1° |
| C13 | C18 | C17 | C16 | 58.8° | 60.1° |
| C18 | C13 | C14 | H9 | 65.6° | 60.0° |
| C18 | C13 | C14 | H10 | 175.0° | 180.0° |
| C13 | C18 | C17 | H19 | 61.4° | 180.0° |
| C13 | C18 | C17 | H20 | 178.9° | 60.0° |
| C13 | C18 | H21 | H22 | 119.2° | 120.1° |
| C14 | C15 | C16 | H11 | 120.2° | 120.0° |
| C14 | C15 | C16 | H12 | 120.2° | 120.0° |
| C14 | C15 | C16 | C17 | 58.6° | 60.0° |
| C14 | C15 | C16 | C19 | 177.7° | 180.0° |
| C15 | C14 | C13 | H8 | 62.6° | 60.0° |
| C15 | C14 | H9 | H10 | 119.1° | 120.0° |
| C14 | C15 | H11 | H12 | 119.4° | 119.9° |
| C14 | C15 | C16 | H13 | 58.7° | 60.0° |
| C5 | C6 | C1 | H28 | 120.2° | 119.9° |
| C5 | C6 | C1 | H29 | 120.2° | 120.0° |
| C5 | C6 | C1 | C2 | 51.9° | 60.0° |
| C5 | C6 | C1 | N | 177.3° | 180.0° |
| C5 | C6 | C1 | H1 | 63.5° | 60.0° |
| C6 | C5 | C4 | H25 | 58.3° | 60.0° |
| C6 | C5 | H26 | H27 | 118.9° | 120.0° |
| C5 | C6 | H28 | H29 | 119.5° | 120.0° |
| C18 | C17 | C16 | C15 | 59.5° | 60.0° |
| C18 | C17 | C16 | H19 | 120.1° | 120.0° |
| C18 | C17 | C16 | H20 | 120.1° | 120.0° |
| C18 | C17 | C16 | C19 | 176.4° | 180.0° |
| C17 | C18 | C13 | H8 | 61.7° | 60.0° |
| C18 | C17 | C16 | H13 | 57.8° | 60.0° |
| C18 | C17 | H19 | H20 | 119.6° | 120.0° |
| C17 | C18 | H21 | H22 | 119.1° | 120.0° |
| C6 | C1 | C2 | C3 | 50.1° | 60.0° |
| C6 | C1 | N | C20 | 80.6° | 60.0° |
| C6 | C1 | C2 | N | 127.1° | 120.0° |
| C6 | C1 | C2 | H1 | 115.5° | 120.0° |
| C6 | C1 | N | H1 | 113.9° | 120.1° |
| C6 | C1 | N | C | 148.8° | 176.0° |
| C6 | C1 | C2 | H2 | 170.6° | 60.0° |
| C6 | C1 | C2 | H3 | 70.4° | 180.0° |
| C1 | C6 | C5 | H26 | 177.1° | 180.0° |
| C1 | C6 | C5 | H27 | 63.6° | 60.0° |
| C1 | C6 | H28 | H29 | 119.4° | 120.0° |
| C3 | C2 | C1 | H2 | 120.5° | 120.0° |
| C3 | C2 | C1 | H3 | 120.5° | 120.0° |
| C3 | C2 | C1 | N | 177.2° | 180.0° |
| C3 | C2 | C1 | H1 | 65.4° | 60.0° |
| C3 | C2 | H2 | H3 | 118.5° | 120.0° |
| C2 | C3 | H4 | H5 | 119.1° | 120.1° |
| C2 | C3 | C4 | H25 | 61.6° | 60.0° |
| C20 | N | C1 | C2 | 48.1° | 180.0° |
| C20 | N | C1 | C | 130.6° | 123.9° |
| C20 | N | C1 | H1 | 165.5° | 60.0° |
| N | C20 | H14 | H15 | 120.0° | 120.0° |
| N | C20 | H14 | H16 | 120.0° | 120.1° |
| N | C20 | H15 | H16 | 120.0° | 120.0° |
| C20 | N | C | H31 | 180.0° | 176.1° |
| C20 | N | C | H32 | 60.0° | 56.0° |
| C20 | N | C | H33 | 60.0° | 64.0° |
| C2 | C1 | N | H1 | 117.4° | 120.0° |
| C2 | C1 | N | C | 82.5° | 56.1° |
| C1 | C2 | H2 | H3 | 118.5° | 120.0° |
| C1 | C2 | C3 | H4 | 68.5° | 180.0° |
| C1 | C2 | C3 | H5 | 172.0° | 60.0° |
| C2 | C1 | C6 | H28 | 68.3° | 180.0° |
| C2 | C1 | C6 | H29 | 172.1° | 60.0° |
| C15 | C16 | C17 | C19 | 124.1° | 120.0° |
| C15 | C16 | C17 | H13 | 117.3° | 120.0° |
| C15 | C16 | C19 | H13 | 118.8° | 120.0° |
| C15 | C16 | C19 | N5 | 156.3° | 180.0° |
| C15 | C16 | C19 | O | 24.2° | 0.1° |
| C16 | C15 | C14 | H9 | 63.3° | 60.0° |
| C16 | C15 | C14 | H10 | 177.3° | 180.0° |
| C16 | C15 | H11 | H12 | 119.5° | 120.1° |
| C15 | C16 | C17 | H19 | 60.6° | 180.0° |
| C15 | C16 | C17 | H20 | 179.6° | 60.0° |
| N | C1 | C2 | H2 | 62.3° | 60.0° |
| N | C1 | C2 | H3 | 56.7° | 60.0° |
| C1 | N | C20 | H14 | 180.0° | 60.0° |
| C1 | N | C20 | H15 | 60.0° | 180.0° |
| C1 | N | C20 | H16 | 60.0° | 60.1° |
| N | C1 | C6 | H28 | 62.5° | 60.1° |
| N | C1 | C6 | H29 | 57.1° | 59.9° |
| C1 | N | C | H31 | 47.7° | 60.0° |
| C1 | N | C | H32 | 72.3° | 180.0° |
| C1 | N | C | H33 | 167.8° | 60.0° |
| C17 | C16 | C19 | H13 | 118.5° | 120.0° |
| C17 | C16 | C19 | N5 | 81.1° | 60.1° |
| C17 | C16 | C19 | O | 98.5° | 120.0° |
| C17 | C16 | C15 | H11 | 178.8° | 180.0° |
| C17 | C16 | C15 | H12 | 61.6° | 60.0° |
| C16 | C17 | H19 | H20 | 119.6° | 120.0° |
| C16 | C17 | C18 | H21 | 179.0° | 180.0° |
| C16 | C17 | C18 | H22 | 61.5° | 60.0° |
| C16 | C19 | N5 | O | 179.5° | 179.9° |
| C19 | C16 | C15 | H11 | 57.5° | 60.0° |
| C19 | C16 | C15 | H12 | 62.2° | 60.0° |
| C16 | C19 | N5 | H17 | 179.5° | 0.1° |
| C16 | C19 | N5 | H18 | 0.5° | 180.0° |
| C19 | C16 | C17 | H19 | 63.5° | 60.0° |
| C19 | C16 | C17 | H20 | 56.2° | 60.0° |
| C | N | C1 | H1 | 34.9° | 63.9° |
| C | N | C20 | H14 | 48.2° | 63.9° |
| C | N | C20 | H15 | 71.8° | 56.0° |
| C | N | C20 | H16 | 168.2° | 176.0° |
| N | C | H31 | H32 | 120.0° | 120.0° |
| N | C | H31 | H33 | 120.0° | 120.0° |
| N | C | H32 | H33 | 120.0° | 120.0° |
| N5 | C19 | C16 | H13 | 37.4° | 60.0° |
| C19 | N5 | H17 | H18 | 180.0° | 179.9° |
| O | C19 | C16 | H13 | 143.0° | 119.9° |
| O | C19 | N5 | H17 | 0.0° | 180.0° |
| O | C19 | N5 | H18 | 180.0° | 0.1° |
| H1 | C1 | C2 | H2 | 55.1° | 180.0° |
| H1 | C1 | C2 | H3 | 174.1° | 60.0° |
| H1 | C1 | C6 | H28 | 176.3° | 60.0° |
| H1 | C1 | C6 | H29 | 56.7° | 180.0° |
| H2 | C2 | C3 | H4 | 52.0° | 60.0° |
| H2 | C2 | C3 | H5 | 67.5° | 180.0° |
| H3 | C2 | C3 | H4 | 171.0° | 60.0° |
| H3 | C2 | C3 | H5 | 51.5° | 60.0° |
| H4 | C3 | C4 | H25 | 178.1° | 60.1° |
| H5 | C3 | C4 | H25 | 58.7° | 180.0° |
| H7 | C12 | N4 | H23 | 4.0° | 0.2° |
| H8 | C13 | C14 | H9 | 177.1° | 180.0° |
| H8 | C13 | C14 | H10 | 57.7° | 60.0° |
| H8 | C13 | C18 | H21 | 58.6° | 60.0° |
| H8 | C13 | C18 | H22 | 178.1° | 180.0° |
| H9 | C14 | C15 | H11 | 56.9° | 60.0° |
| H9 | C14 | C15 | H12 | 176.5° | 179.9° |
| H10 | C14 | C15 | H11 | 62.5° | 59.9° |
| H10 | C14 | C15 | H12 | 57.1° | 60.0° |
| H11 | C15 | C16 | H13 | 61.5° | 60.0° |
| H12 | C15 | C16 | H13 | 178.9° | 179.9° |
| H13 | C16 | C17 | H19 | 177.9° | 60.0° |
| H13 | C16 | C17 | H20 | 62.4° | 180.0° |
| H14 | C20 | H15 | H16 | 120.0° | 120.0° |
| H19 | C17 | C18 | H21 | 58.9° | 60.0° |
| H19 | C17 | C18 | H22 | 178.3° | 59.9° |
| H20 | C17 | C18 | H21 | 60.8° | 60.0° |
| H20 | C17 | C18 | H22 | 58.6° | 180.0° |
| H24 | N1 | C4 | H25 | 153.1° | 145.0° |
| H25 | C4 | C5 | H26 | 62.0° | 60.0° |
| H25 | C4 | C5 | H27 | 178.7° | 180.0° |
| H26 | C5 | C6 | H28 | 56.9° | 60.0° |
| H26 | C5 | C6 | H29 | 62.7° | 60.0° |
| H27 | C5 | C6 | H28 | 176.2° | 60.0° |
| H27 | C5 | C6 | H29 | 56.5° | 180.0° |
| H31 | C | H32 | H33 | 120.0° | 120.0° |
