05S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.49Å | |
| C22 | C3 | sing | 1.51Å | 1.51Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | doub | 1.36Å | 1.40Å | Aromatic |
| C2 | C5 | sing | 1.45Å | 1.42Å | Aromatic |
| C3 | N1 | sing | 1.37Å | 1.40Å | Aromatic |
| C13 | C14 | doub | 1.37Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.46Å | 1.46Å | |
| C5 | C4 | doub | 1.39Å | 1.37Å | Aromatic |
| N4 | C24 | sing | 1.35Å | 1.38Å | |
| N1 | C4 | sing | 1.35Å | 1.38Å | Aromatic |
| N1 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C21 | C20 | sing | 1.52Å | 1.53Å | |
| O1 | C6 | doub | 1.21Å | 1.23Å | |
| C6 | C7 | sing | 1.51Å | 1.53Å | |
| C4 | C9 | sing | 1.51Å | 1.50Å | |
| C12 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
| C20 | N3 | sing | 1.49Å | 1.51Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| C15 | C24 | sing | 1.47Å | 1.49Å | |
| C15 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.55Å | |
| C24 | O2 | doub | 1.22Å | 1.22Å | |
| N3 | C19 | sing | 1.50Å | 1.50Å | |
| C17 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | N2 | sing | 1.40Å | 1.39Å | |
| C8 | C10 | sing | 1.53Å | 1.55Å | |
| C8 | C11 | sing | 1.53Å | 1.54Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| N2 | C18 | sing | 1.47Å | 1.47Å | |
| C18 | C23 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.10Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| N2 | H17 | sing | 0.97Å | 1.00Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.08Å | 1.10Å | |
| N3 | H21 | sing | 1.07Å | 1.00Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.08Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.11Å | 1.10Å | |
| C22 | H28 | sing | 1.07Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| N4 | H32 | sing | 0.97Å | 1.00Å | |
| N4 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 127.1° | 126.9° |
| C1 | C2 | C5 | 125.7° | 127.0° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.4° |
| C3 | C22 | C21 | 115.4° | 109.7° |
| C22 | C3 | C2 | 128.5° | 120.8° |
| C22 | C3 | N1 | 124.0° | 129.6° |
| C3 | C22 | H27 | 107.5° | 107.6° |
| C3 | C22 | H28 | 107.5° | 112.8° |
| C22 | C21 | C20 | 118.1° | 111.2° |
| C22 | C21 | H25 | 106.7° | 109.3° |
| C22 | C21 | H26 | 106.7° | 109.4° |
| C21 | C22 | H27 | 107.6° | 107.6° |
| C21 | C22 | H28 | 107.5° | 112.6° |
| C3 | C2 | C5 | 107.2° | 106.1° |
| C2 | C3 | N1 | 107.3° | 109.5° |
| C2 | C5 | C6 | 131.4° | 130.8° |
| C2 | C5 | C4 | 107.8° | 106.5° |
| C3 | N1 | C4 | 108.8° | 109.4° |
| C3 | N1 | C12 | 127.8° | 127.4° |
| C14 | C13 | C12 | 118.7° | 121.5° |
| C13 | C14 | C15 | 121.0° | 120.4° |
| C14 | C13 | H14 | 120.6° | 117.0° |
| C13 | C14 | H15 | 119.5° | 119.8° |
| C13 | C12 | N1 | 122.9° | 119.9° |
| C13 | C12 | C17 | 120.0° | 117.9° |
| C12 | C13 | H14 | 120.7° | 121.4° |
| C14 | C15 | C24 | 119.1° | 119.5° |
| C14 | C15 | C16 | 120.5° | 119.0° |
| C15 | C14 | H15 | 119.5° | 119.9° |
| C6 | C5 | C4 | 120.7° | 122.7° |
| C5 | C6 | O1 | 121.2° | 122.0° |
| C5 | C6 | C7 | 117.4° | 116.7° |
| C5 | C4 | N1 | 108.8° | 108.0° |
| C5 | C4 | C9 | 125.3° | 121.0° |
| N4 | C24 | C15 | 116.9° | 120.0° |
| N4 | C24 | O2 | 123.2° | 120.0° |
| C24 | N4 | H32 | 120.0° | 120.0° |
| C24 | N4 | H33 | 120.0° | 120.0° |
| C4 | N1 | C12 | 123.4° | 123.3° |
| N1 | C4 | C9 | 125.8° | 131.0° |
| N1 | C12 | C17 | 117.0° | 122.2° |
| C21 | C20 | N3 | 111.4° | 109.0° |
| C21 | C20 | H23 | 108.8° | 110.0° |
| C21 | C20 | H24 | 108.8° | 110.4° |
| C20 | C21 | H25 | 106.7° | 109.4° |
| C20 | C21 | H26 | 106.7° | 108.9° |
| O1 | C6 | C7 | 119.6° | 121.3° |
| C6 | C7 | C8 | 114.3° | 109.6° |
| C6 | C7 | H4 | 107.9° | 109.5° |
| C6 | C7 | H5 | 107.9° | 109.3° |
| C4 | C9 | C8 | 110.7° | 110.8° |
| C4 | C9 | H6 | 109.1° | 109.8° |
| C4 | C9 | H7 | 109.1° | 109.2° |
| C12 | C17 | C16 | 122.8° | 121.4° |
| C12 | C17 | H16 | 118.6° | 120.7° |
| C20 | N3 | C19 | 117.3° | 106.3° |
| C20 | N3 | H21 | 106.9° | 101.9° |
| N3 | C20 | H23 | 108.8° | 108.0° |
| N3 | C20 | H24 | 108.8° | 109.0° |
| C7 | C8 | C9 | 110.7° | 111.7° |
| C7 | C8 | C10 | 111.1° | 108.6° |
| C7 | C8 | C11 | 108.3° | 109.6° |
| C8 | C7 | H4 | 107.9° | 109.6° |
| C8 | C7 | H5 | 107.9° | 109.4° |
| C24 | C15 | C16 | 120.4° | 121.5° |
| C15 | C24 | O2 | 119.8° | 120.0° |
| C15 | C16 | C17 | 116.7° | 119.4° |
| C15 | C16 | N2 | 122.5° | 120.5° |
| C9 | C8 | C10 | 109.9° | 108.7° |
| C9 | C8 | C11 | 108.5° | 109.6° |
| C8 | C9 | H6 | 109.0° | 109.4° |
| C8 | C9 | H7 | 109.1° | 108.1° |
| N3 | C19 | C18 | 113.4° | 108.2° |
| N3 | C19 | H19 | 108.2° | 108.3° |
| N3 | C19 | H20 | 108.2° | 108.8° |
| C19 | N3 | H21 | 106.9° | 101.7° |
| C17 | C16 | N2 | 120.7° | 120.1° |
| C16 | C17 | H16 | 118.6° | 117.7° |
| C16 | N2 | C18 | 126.3° | 119.6° |
| C16 | N2 | H17 | 104.3° | 121.5° |
| C10 | C8 | C11 | 108.2° | 108.5° |
| C8 | C10 | H8 | 109.5° | 109.5° |
| C8 | C10 | H9 | 109.5° | 109.5° |
| C8 | C10 | H10 | 109.4° | 109.5° |
| C8 | C11 | H11 | 109.5° | 109.4° |
| C8 | C11 | H12 | 109.4° | 109.5° |
| C8 | C11 | H13 | 109.5° | 109.4° |
| C19 | C18 | N2 | 111.8° | 110.1° |
| C19 | C18 | C23 | 109.8° | 109.3° |
| C19 | C18 | H18 | 107.0° | 109.7° |
| C18 | C19 | H19 | 108.2° | 110.2° |
| C18 | C19 | H20 | 108.2° | 110.3° |
| N2 | C18 | C23 | 107.5° | 109.1° |
| C18 | N2 | H17 | 104.2° | 118.9° |
| N2 | C18 | H18 | 109.4° | 109.4° |
| C23 | C18 | H18 | 111.4° | 109.1° |
| C18 | C23 | H29 | 109.5° | 109.5° |
| C18 | C23 | H30 | 109.5° | 109.5° |
| C18 | C23 | H31 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H4 | C7 | H5 | 111.0° | 109.4° |
| H6 | C9 | H7 | 109.9° | 109.6° |
| H8 | C10 | H9 | 109.4° | 109.4° |
| H8 | C10 | H10 | 109.5° | 109.4° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H11 | C11 | H12 | 109.5° | 109.5° |
| H11 | C11 | H13 | 109.5° | 109.5° |
| H12 | C11 | H13 | 109.5° | 109.5° |
| H19 | C19 | H20 | 110.7° | 110.9° |
| H23 | C20 | H24 | 110.1° | 110.5° |
| H25 | C21 | H26 | 112.1° | 108.6° |
| H27 | C22 | H28 | 111.4° | 106.2° |
| H29 | C23 | H30 | 109.5° | 109.5° |
| H29 | C23 | H31 | 109.5° | 109.5° |
| H30 | C23 | H31 | 109.5° | 109.5° |
| H32 | N4 | H33 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C22 | 5.1° | 3.0° |
| C1 | C2 | C3 | C5 | 178.0° | 178.5° |
| C1 | C2 | C3 | N1 | 179.8° | 178.3° |
| C1 | C2 | C5 | C6 | 1.6° | 3.2° |
| C1 | C2 | C5 | C4 | 178.5° | 177.1° |
| C2 | C1 | H1 | H2 | 120.0° | 120.1° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C3 | C22 | C21 | H27 | 120.0° | 116.8° |
| C3 | C22 | C21 | H28 | 120.0° | 126.5° |
| C22 | C3 | C2 | N1 | 174.7° | 178.7° |
| C22 | C3 | C2 | C5 | 176.9° | 175.6° |
| C22 | C3 | N1 | C4 | 175.1° | 171.7° |
| C22 | C3 | N1 | C12 | 4.8° | 9.6° |
| C3 | C22 | C21 | C20 | 132.1° | 108.2° |
| C3 | C22 | C21 | H25 | 107.9° | 130.9° |
| C3 | C22 | C21 | H26 | 12.1° | 12.1° |
| C3 | C22 | H27 | H28 | 117.6° | 121.0° |
| C21 | C22 | C3 | C2 | 73.9° | 71.5° |
| C21 | C22 | C3 | N1 | 112.2° | 110.1° |
| C22 | C21 | C20 | H25 | 120.0° | 120.8° |
| C22 | C21 | C20 | H26 | 120.0° | 120.6° |
| C22 | C21 | C20 | N3 | 46.8° | 52.0° |
| C22 | C21 | C20 | H23 | 73.2° | 170.2° |
| C22 | C21 | C20 | H24 | 166.7° | 67.6° |
| C22 | C21 | H25 | H26 | 116.5° | 119.3° |
| C21 | C22 | H27 | H28 | 117.6° | 120.8° |
| C3 | C2 | C5 | C6 | 179.6° | 178.2° |
| C3 | C2 | C5 | C4 | 3.5° | 1.5° |
| C2 | C3 | N1 | C4 | 0.1° | 6.8° |
| C2 | C3 | N1 | C12 | 179.8° | 171.8° |
| C3 | C2 | C1 | H1 | 91.2° | 90.0° |
| C3 | C2 | C1 | H2 | 148.8° | 149.9° |
| C3 | C2 | C1 | H3 | 28.8° | 30.0° |
| C2 | C3 | C22 | H27 | 166.1° | 45.3° |
| C2 | C3 | C22 | H28 | 46.1° | 162.1° |
| C5 | C2 | C3 | N1 | 2.2° | 3.1° |
| C2 | C5 | C6 | C4 | 176.6° | 179.7° |
| C2 | C5 | C4 | N1 | 3.4° | 5.6° |
| C2 | C5 | C6 | O1 | 17.3° | 2.1° |
| C2 | C5 | C6 | C7 | 178.2° | 177.8° |
| C2 | C5 | C4 | C9 | 179.8° | 173.5° |
| C5 | C2 | C1 | H1 | 91.2° | 91.8° |
| C5 | C2 | C1 | H2 | 28.9° | 28.3° |
| C5 | C2 | C1 | H3 | 148.9° | 148.2° |
| C3 | N1 | C12 | C13 | 119.6° | 179.0° |
| C3 | N1 | C4 | C5 | 2.1° | 7.6° |
| C3 | N1 | C4 | C12 | 180.0° | 178.7° |
| C3 | N1 | C4 | C9 | 178.8° | 171.3° |
| C3 | N1 | C12 | C17 | 57.9° | 1.3° |
| N1 | C3 | C22 | H27 | 7.8° | 133.1° |
| N1 | C3 | C22 | H28 | 127.8° | 16.3° |
| C14 | C13 | C12 | H14 | 180.0° | 177.0° |
| C13 | C14 | C15 | H15 | 180.0° | 179.9° |
| C14 | C13 | C12 | N1 | 174.6° | 175.9° |
| C14 | C13 | C12 | C17 | 2.8° | 6.3° |
| C13 | C14 | C15 | C24 | 179.1° | 178.5° |
| C13 | C14 | C15 | C16 | 0.5° | 2.0° |
| C12 | C13 | C14 | C15 | 0.1° | 1.8° |
| C13 | C12 | N1 | C4 | 60.4° | 0.6° |
| C13 | C12 | N1 | C17 | 177.5° | 177.7° |
| C13 | C12 | C17 | C16 | 5.2° | 7.0° |
| C12 | C13 | C14 | H15 | 179.9° | 178.0° |
| C13 | C12 | C17 | H16 | 174.8° | 168.3° |
| C14 | C15 | C24 | N4 | 22.9° | 0.0° |
| C14 | C15 | C24 | C16 | 178.5° | 179.5° |
| C14 | C15 | C24 | O2 | 156.2° | 180.0° |
| C14 | C15 | C16 | C17 | 1.5° | 1.2° |
| C14 | C15 | C16 | N2 | 178.3° | 178.7° |
| C15 | C14 | C13 | H14 | 179.9° | 175.3° |
| C6 | C5 | C4 | N1 | 179.3° | 174.2° |
| C5 | C6 | O1 | C7 | 164.1° | 179.9° |
| C6 | C5 | C4 | C9 | 2.6° | 6.7° |
| C5 | C6 | C7 | C8 | 25.5° | 34.3° |
| C5 | C6 | C7 | H4 | 145.5° | 154.5° |
| C5 | C6 | C7 | H5 | 94.5° | 85.6° |
| C5 | C4 | N1 | C9 | 176.7° | 179.0° |
| C5 | C4 | N1 | C12 | 178.0° | 171.0° |
| C4 | C5 | C6 | O1 | 166.1° | 178.3° |
| C4 | C5 | C6 | C7 | 1.7° | 1.8° |
| C5 | C4 | C9 | C8 | 23.2° | 18.4° |
| C5 | C4 | C9 | H6 | 96.7° | 102.6° |
| C5 | C4 | C9 | H7 | 143.2° | 137.3° |
| N4 | C24 | C15 | O2 | 179.1° | 180.0° |
| N4 | C24 | C15 | C16 | 158.6° | 179.5° |
| C24 | N4 | H32 | H33 | 180.0° | 180.0° |
| C4 | N1 | C12 | C17 | 122.1° | 177.1° |
| N1 | C4 | C9 | C8 | 152.9° | 160.5° |
| N1 | C4 | C9 | H6 | 87.1° | 78.5° |
| N1 | C4 | C9 | H7 | 32.9° | 41.6° |
| C12 | N1 | C4 | C9 | 1.3° | 10.0° |
| N1 | C12 | C17 | C16 | 172.4° | 175.2° |
| N1 | C12 | C13 | H14 | 5.4° | 7.0° |
| N1 | C12 | C17 | H16 | 7.6° | 9.4° |
| C21 | C20 | N3 | H23 | 120.0° | 119.5° |
| C21 | C20 | N3 | H24 | 120.0° | 120.5° |
| C21 | C20 | N3 | C19 | 130.1° | 147.8° |
| C21 | C20 | N3 | H21 | 10.1° | 106.1° |
| C21 | C20 | H23 | H24 | 119.2° | 122.1° |
| C20 | C21 | H25 | H26 | 116.4° | 118.7° |
| C20 | C21 | C22 | H27 | 12.1° | 135.0° |
| C20 | C21 | C22 | H28 | 107.9° | 18.3° |
| O1 | C6 | C7 | C8 | 139.2° | 145.8° |
| O1 | C6 | C7 | H4 | 19.2° | 25.6° |
| O1 | C6 | C7 | H5 | 100.8° | 94.3° |
| C6 | C7 | C8 | H4 | 120.0° | 120.2° |
| C6 | C7 | C8 | H5 | 120.0° | 119.9° |
| C6 | C7 | C8 | C9 | 50.2° | 59.8° |
| C6 | C7 | C8 | C10 | 172.6° | 179.7° |
| C6 | C7 | C8 | C11 | 68.7° | 61.9° |
| C6 | C7 | H4 | H5 | 118.0° | 119.8° |
| C4 | C9 | C8 | C7 | 47.7° | 51.6° |
| C4 | C9 | C8 | H6 | 120.0° | 121.2° |
| C4 | C9 | C8 | H7 | 120.0° | 119.6° |
| C4 | C9 | C8 | C10 | 170.8° | 171.5° |
| C4 | C9 | C8 | C11 | 71.1° | 70.0° |
| C4 | C9 | H6 | H7 | 119.5° | 119.9° |
| C12 | C17 | C16 | C15 | 4.4° | 3.4° |
| C12 | C17 | C16 | H16 | 180.0° | 175.5° |
| C12 | C17 | C16 | N2 | 178.8° | 176.7° |
| C17 | C12 | C13 | H14 | 177.2° | 170.8° |
| C20 | N3 | C19 | H21 | 120.0° | 106.2° |
| C20 | N3 | C19 | C18 | 143.3° | 128.8° |
| C20 | N3 | C19 | H19 | 96.6° | 111.7° |
| C20 | N3 | C19 | H20 | 23.3° | 8.9° |
| N3 | C20 | H23 | H24 | 119.2° | 119.1° |
| N3 | C20 | C21 | H25 | 166.8° | 68.8° |
| N3 | C20 | C21 | H26 | 73.3° | 172.6° |
| C7 | C8 | C9 | C10 | 123.1° | 119.9° |
| C7 | C8 | C9 | C11 | 118.8° | 121.7° |
| C7 | C8 | C10 | C11 | 118.8° | 119.0° |
| C8 | C7 | H4 | H5 | 118.0° | 119.9° |
| C7 | C8 | C9 | H6 | 72.3° | 69.5° |
| C7 | C8 | C9 | H7 | 167.7° | 171.2° |
| C7 | C8 | C10 | H8 | 180.0° | 60.0° |
| C7 | C8 | C10 | H9 | 60.0° | 180.0° |
| C7 | C8 | C10 | H10 | 60.0° | 60.0° |
| C7 | C8 | C11 | H11 | 180.0° | 60.0° |
| C7 | C8 | C11 | H12 | 60.0° | 180.0° |
| C7 | C8 | C11 | H13 | 60.0° | 60.0° |
| C24 | C15 | C16 | C17 | 177.0° | 179.3° |
| C24 | C15 | C16 | N2 | 0.3° | 0.8° |
| C24 | C15 | C14 | H15 | 0.9° | 1.3° |
| C15 | C24 | N4 | H32 | 179.0° | 0.0° |
| C15 | C24 | N4 | H33 | 1.0° | 180.0° |
| C16 | C15 | C24 | O2 | 22.3° | 0.5° |
| C15 | C16 | C17 | N2 | 176.8° | 179.9° |
| C15 | C16 | N2 | C18 | 176.8° | 166.9° |
| C16 | C15 | C14 | H15 | 179.4° | 178.2° |
| C15 | C16 | C17 | H16 | 175.6° | 172.1° |
| C15 | C16 | N2 | H17 | 56.8° | 13.8° |
| C9 | C8 | C10 | C11 | 118.3° | 119.2° |
| C9 | C8 | C7 | H4 | 170.2° | 179.9° |
| C9 | C8 | C7 | H5 | 69.8° | 60.1° |
| C8 | C9 | H6 | H7 | 119.5° | 118.3° |
| C9 | C8 | C10 | H8 | 57.1° | 61.8° |
| C9 | C8 | C10 | H9 | 177.1° | 58.2° |
| C9 | C8 | C10 | H10 | 62.9° | 178.3° |
| C9 | C8 | C11 | H11 | 59.7° | 177.1° |
| C9 | C8 | C11 | H12 | 60.3° | 57.0° |
| C9 | C8 | C11 | H13 | 179.7° | 62.9° |
| O2 | C24 | N4 | H32 | 0.0° | 179.9° |
| O2 | C24 | N4 | H33 | 180.0° | 0.0° |
| N3 | C19 | C18 | H19 | 120.0° | 118.3° |
| N3 | C19 | C18 | H20 | 120.0° | 118.9° |
| N3 | C19 | C18 | N2 | 48.3° | 130.1° |
| N3 | C19 | C18 | C23 | 167.5° | 110.0° |
| N3 | C19 | C18 | H18 | 71.5° | 9.6° |
| N3 | C19 | H19 | H20 | 118.4° | 119.3° |
| C19 | N3 | C20 | H23 | 109.9° | 92.7° |
| C19 | N3 | C20 | H24 | 10.2° | 27.4° |
| C17 | C16 | N2 | C18 | 0.2° | 13.2° |
| C17 | C16 | N2 | H17 | 119.8° | 166.1° |
| C16 | N2 | C18 | C19 | 79.3° | 80.6° |
| C16 | N2 | C18 | H17 | 120.0° | 179.3° |
| C16 | N2 | C18 | C23 | 160.1° | 159.4° |
| N2 | C16 | C17 | H16 | 1.2° | 7.8° |
| C16 | N2 | C18 | H18 | 39.0° | 40.0° |
| C10 | C8 | C7 | H4 | 67.4° | 60.2° |
| C10 | C8 | C7 | H5 | 52.6° | 59.8° |
| C10 | C8 | C9 | H6 | 50.8° | 50.3° |
| C10 | C8 | C9 | H7 | 69.2° | 68.9° |
| C8 | C10 | H8 | H9 | 120.0° | 120.0° |
| C8 | C10 | H8 | H10 | 120.0° | 120.0° |
| C8 | C10 | H9 | H10 | 120.0° | 120.1° |
| C10 | C8 | C11 | H11 | 59.5° | 58.5° |
| C10 | C8 | C11 | H12 | 179.5° | 61.6° |
| C10 | C8 | C11 | H13 | 60.5° | 178.5° |
| C11 | C8 | C7 | H4 | 51.3° | 58.2° |
| C11 | C8 | C7 | H5 | 171.3° | 178.2° |
| C11 | C8 | C9 | H6 | 168.9° | 168.8° |
| C11 | C8 | C9 | H7 | 48.9° | 49.5° |
| C11 | C8 | C10 | H8 | 61.2° | 179.0° |
| C11 | C8 | C10 | H9 | 58.8° | 61.0° |
| C11 | C8 | C10 | H10 | 178.8° | 59.1° |
| C8 | C11 | H11 | H12 | 120.0° | 120.0° |
| C8 | C11 | H11 | H13 | 120.0° | 120.0° |
| C8 | C11 | H12 | H13 | 120.0° | 120.0° |
| C19 | C18 | N2 | C23 | 120.6° | 120.0° |
| C19 | C18 | N2 | H18 | 118.4° | 120.6° |
| C19 | C18 | C23 | H18 | 118.4° | 119.9° |
| C19 | C18 | N2 | H17 | 160.6° | 98.7° |
| C18 | C19 | H19 | H20 | 118.4° | 122.5° |
| C18 | C19 | N3 | H21 | 23.3° | 124.9° |
| C19 | C18 | C23 | H29 | 180.0° | 60.5° |
| C19 | C18 | C23 | H30 | 60.0° | 59.5° |
| C19 | C18 | C23 | H31 | 60.0° | 179.5° |
| N2 | C18 | C23 | H18 | 119.8° | 119.6° |
| N2 | C18 | C19 | H19 | 71.8° | 111.6° |
| N2 | C18 | C19 | H20 | 168.3° | 11.1° |
| N2 | C18 | C23 | H29 | 58.2° | 60.0° |
| N2 | C18 | C23 | H30 | 61.9° | 180.0° |
| N2 | C18 | C23 | H31 | 178.2° | 60.0° |
| C23 | C18 | N2 | H17 | 40.0° | 21.3° |
| C23 | C18 | C19 | H19 | 47.5° | 8.3° |
| C23 | C18 | C19 | H20 | 72.5° | 131.0° |
| C18 | C23 | H29 | H30 | 120.0° | 120.0° |
| C18 | C23 | H29 | H31 | 120.0° | 120.0° |
| C18 | C23 | H30 | H31 | 120.0° | 120.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H8 | C10 | H9 | H10 | 120.0° | 119.9° |
| H11 | C11 | H12 | H13 | 120.0° | 120.1° |
| H14 | C13 | C14 | H15 | 0.1° | 4.8° |
| H17 | N2 | C18 | H18 | 81.0° | 140.7° |
| H18 | C18 | C19 | H19 | 168.5° | 127.9° |
| H18 | C18 | C19 | H20 | 48.5° | 109.3° |
| H18 | C18 | C23 | H29 | 61.7° | 179.6° |
| H18 | C18 | C23 | H30 | 178.3° | 60.5° |
| H18 | C18 | C23 | H31 | 58.4° | 59.6° |
| H19 | C19 | N3 | H21 | 143.3° | 5.5° |
| H20 | C19 | N3 | H21 | 96.7° | 115.2° |
| H21 | N3 | C20 | H23 | 130.1° | 13.4° |
| H21 | N3 | C20 | H24 | 109.9° | 133.4° |
| H23 | C20 | C21 | H25 | 46.8° | 49.4° |
| H23 | C20 | C21 | H26 | 166.8° | 69.2° |
| H24 | C20 | C21 | H25 | 73.3° | 171.6° |
| H24 | C20 | C21 | H26 | 46.7° | 53.0° |
| H25 | C21 | C22 | H27 | 132.1° | 14.2° |
| H25 | C21 | C22 | H28 | 12.0° | 102.6° |
| H26 | C21 | C22 | H27 | 107.9° | 104.7° |
| H26 | C21 | C22 | H28 | 132.1° | 138.6° |
| H29 | C23 | H30 | H31 | 120.0° | 120.0° |
