GJJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C23 | sing | 1.54Å | 1.53Å | |
| C22 | N7 | sing | 1.48Å | 1.46Å | |
| C23 | C24 | sing | 1.55Å | 1.51Å | |
| C5 | C4 | doub | 1.37Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.40Å | 1.37Å | Aromatic |
| N7 | C6 | sing | 1.38Å | 1.38Å | |
| N7 | C25 | sing | 1.49Å | 1.45Å | |
| C6 | N1 | doub | 1.32Å | 1.35Å | Aromatic |
| C24 | N26 | sing | 1.47Å | 1.47Å | |
| C24 | C25 | sing | 1.55Å | 1.54Å | |
| N26 | C30 | sing | 1.35Å | 1.34Å | |
| N28 | C27 | sing | 1.35Å | 1.39Å | |
| C3 | C27 | sing | 1.47Å | 1.51Å | |
| C3 | C2 | doub | 1.41Å | 1.48Å | Aromatic |
| C32 | C30 | sing | 1.47Å | 1.51Å | |
| C32 | C33 | doub | 1.33Å | 1.53Å | |
| C30 | O31 | doub | 1.22Å | 1.23Å | |
| C27 | O29 | doub | 1.22Å | 1.21Å | |
| N1 | C2 | sing | 1.32Å | 1.35Å | Aromatic |
| C2 | N8 | sing | 1.38Å | 1.36Å | |
| N8 | C9 | sing | 1.39Å | 1.35Å | |
| C14 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | doub | 1.40Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C12 | C15 | sing | 1.48Å | 1.50Å | |
| O17 | C15 | doub | 1.22Å | 1.23Å | |
| C15 | N16 | sing | 1.35Å | 1.35Å | |
| N16 | C18 | sing | 1.46Å | 1.47Å | |
| C21 | C18 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C20 | sing | 1.53Å | 1.53Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C19 | H5 | sing | 1.09Å | 1.10Å | |
| C19 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| N26 | H17 | sing | 0.97Å | 1.00Å | |
| C32 | H18 | sing | 1.08Å | 1.08Å | |
| C33 | H20 | sing | 1.08Å | 1.08Å | |
| C33 | H21 | sing | 1.08Å | 1.08Å | |
| C4 | H23 | sing | 1.08Å | 1.08Å | |
| C5 | H24 | sing | 1.08Å | 1.08Å | |
| N8 | H25 | sing | 0.97Å | 1.00Å | |
| N16 | H26 | sing | 0.97Å | 1.00Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| N28 | H31 | sing | 0.97Å | 1.00Å | |
| N28 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | N7 | 102.0° | 107.1° |
| C22 | C23 | C24 | 105.3° | 105.1° |
| C23 | C22 | H14 | 111.3° | 109.9° |
| C23 | C22 | H15 | 111.3° | 110.0° |
| C22 | C23 | H27 | 110.5° | 110.4° |
| C22 | C23 | H28 | 110.5° | 110.3° |
| C22 | N7 | C6 | 121.6° | 111.0° |
| C22 | N7 | C25 | 116.5° | 105.8° |
| N7 | C22 | H14 | 111.3° | 109.9° |
| N7 | C22 | H15 | 111.3° | 109.9° |
| C23 | C24 | N26 | 106.1° | 110.7° |
| C23 | C24 | C25 | 106.7° | 102.9° |
| C23 | C24 | H16 | 109.1° | 110.9° |
| C24 | C23 | H27 | 110.5° | 110.3° |
| C24 | C23 | H28 | 110.5° | 110.3° |
| C4 | C5 | C6 | 118.9° | 119.6° |
| C5 | C4 | C3 | 118.4° | 118.6° |
| C5 | C4 | H23 | 120.8° | 120.7° |
| C4 | C5 | H24 | 120.6° | 120.3° |
| C5 | C6 | N7 | 121.3° | 119.5° |
| C5 | C6 | N1 | 122.7° | 121.1° |
| C6 | C5 | H24 | 120.5° | 120.2° |
| C4 | C3 | C27 | 118.7° | 120.5° |
| C4 | C3 | C2 | 121.3° | 119.0° |
| C3 | C4 | H23 | 120.8° | 120.7° |
| C6 | N7 | C25 | 121.8° | 111.0° |
| N7 | C6 | N1 | 115.9° | 119.4° |
| N7 | C25 | C24 | 101.2° | 103.2° |
| N7 | C25 | H29 | 111.5° | 110.7° |
| N7 | C25 | H30 | 111.5° | 110.6° |
| C6 | N1 | C2 | 121.6° | 121.5° |
| N26 | C24 | C25 | 116.5° | 110.7° |
| C24 | N26 | C30 | 123.7° | 120.0° |
| N26 | C24 | H16 | 109.6° | 110.6° |
| C24 | N26 | H17 | 118.2° | 120.0° |
| C25 | C24 | H16 | 108.6° | 110.8° |
| C24 | C25 | H29 | 111.5° | 110.7° |
| C24 | C25 | H30 | 111.5° | 110.7° |
| N26 | C30 | C32 | 118.2° | 120.0° |
| N26 | C30 | O31 | 126.4° | 119.9° |
| C30 | N26 | H17 | 118.1° | 120.0° |
| N28 | C27 | C3 | 116.8° | 120.0° |
| N28 | C27 | O29 | 122.8° | 120.1° |
| C27 | N28 | H31 | 120.0° | 120.0° |
| C27 | N28 | H32 | 120.0° | 119.9° |
| C27 | C3 | C2 | 120.0° | 120.5° |
| C3 | C27 | O29 | 120.3° | 120.0° |
| C3 | C2 | N1 | 117.1° | 120.3° |
| C3 | C2 | N8 | 121.3° | 119.9° |
| C30 | C32 | C33 | 119.5° | 119.9° |
| C32 | C30 | O31 | 115.3° | 120.1° |
| C30 | C32 | H18 | 120.2° | 120.0° |
| C33 | C32 | H18 | 120.3° | 120.1° |
| C32 | C33 | H20 | 120.0° | 120.0° |
| C32 | C33 | H21 | 120.0° | 120.1° |
| N1 | C2 | N8 | 121.6° | 119.8° |
| C2 | N8 | C9 | 128.8° | 120.0° |
| C2 | N8 | H25 | 115.6° | 120.0° |
| N8 | C9 | C14 | 123.0° | 119.9° |
| N8 | C9 | C10 | 117.3° | 119.9° |
| C9 | N8 | H25 | 115.6° | 120.0° |
| C9 | C14 | C13 | 120.4° | 120.0° |
| C14 | C9 | C10 | 119.6° | 120.2° |
| C9 | C14 | H4 | 119.8° | 119.9° |
| C14 | C13 | C12 | 120.0° | 119.9° |
| C14 | C13 | H3 | 120.0° | 120.0° |
| C13 | C14 | H4 | 119.8° | 120.0° |
| C9 | C10 | C11 | 120.1° | 120.1° |
| C9 | C10 | H1 | 120.0° | 120.0° |
| C13 | C12 | C11 | 120.1° | 119.9° |
| C13 | C12 | C15 | 115.5° | 120.1° |
| C12 | C13 | H3 | 120.0° | 120.1° |
| C10 | C11 | C12 | 119.6° | 119.9° |
| C11 | C10 | H1 | 119.9° | 119.9° |
| C10 | C11 | H2 | 120.2° | 120.1° |
| C11 | C12 | C15 | 124.0° | 120.1° |
| C12 | C11 | H2 | 120.2° | 120.0° |
| C12 | C15 | O17 | 116.2° | 120.0° |
| C12 | C15 | N16 | 119.7° | 120.0° |
| O17 | C15 | N16 | 123.5° | 120.1° |
| C15 | N16 | C18 | 124.5° | 120.0° |
| C15 | N16 | H26 | 117.7° | 120.0° |
| N16 | C18 | C21 | 108.9° | 109.5° |
| N16 | C18 | C19 | 111.9° | 109.5° |
| N16 | C18 | C20 | 108.5° | 109.5° |
| C18 | N16 | H26 | 117.7° | 120.0° |
| C21 | C18 | C19 | 110.3° | 109.4° |
| C21 | C18 | C20 | 107.7° | 109.5° |
| C18 | C21 | H11 | 109.5° | 109.5° |
| C18 | C21 | H12 | 109.5° | 109.5° |
| C18 | C21 | H13 | 109.5° | 109.5° |
| C19 | C18 | C20 | 109.4° | 109.5° |
| C18 | C19 | H5 | 109.5° | 109.5° |
| C18 | C19 | H6 | 109.5° | 109.4° |
| C18 | C19 | H7 | 109.5° | 109.4° |
| C18 | C20 | H8 | 109.5° | 109.5° |
| C18 | C20 | H9 | 109.4° | 109.5° |
| C18 | C20 | H10 | 109.5° | 109.5° |
| H5 | C19 | H6 | 109.5° | 109.5° |
| H5 | C19 | H7 | 109.4° | 109.5° |
| H6 | C19 | H7 | 109.4° | 109.5° |
| H8 | C20 | H9 | 109.5° | 109.5° |
| H8 | C20 | H10 | 109.5° | 109.4° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H11 | C21 | H13 | 109.4° | 109.5° |
| H12 | C21 | H13 | 109.5° | 109.5° |
| H14 | C22 | H15 | 109.4° | 110.0° |
| H20 | C33 | H21 | 120.0° | 120.0° |
| H27 | C23 | H28 | 109.5° | 110.4° |
| H29 | C25 | H30 | 109.5° | 110.8° |
| H31 | N28 | H32 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | N7 | H14 | 118.8° | 119.4° |
| C23 | C22 | N7 | H15 | 118.8° | 119.4° |
| C22 | C23 | C24 | H27 | 119.3° | 119.0° |
| C22 | C23 | C24 | H28 | 119.3° | 118.8° |
| C23 | C22 | N7 | C6 | 173.2° | 145.8° |
| C23 | C22 | N7 | C25 | 9.0° | 25.3° |
| C22 | C23 | C24 | N26 | 95.0° | 140.4° |
| C22 | C23 | C24 | C25 | 29.8° | 22.0° |
| C23 | C22 | H14 | H15 | 123.5° | 121.2° |
| C22 | C23 | C24 | H16 | 147.0° | 96.5° |
| C22 | C23 | H27 | H28 | 121.9° | 122.1° |
| N7 | C22 | C23 | C24 | 23.3° | 1.2° |
| C22 | N7 | C6 | C5 | 5.9° | 49.9° |
| C22 | N7 | C6 | C25 | 177.6° | 117.3° |
| C22 | N7 | C6 | N1 | 176.4° | 129.8° |
| C22 | N7 | C25 | C24 | 8.7° | 39.2° |
| N7 | C22 | H14 | H15 | 123.5° | 121.2° |
| N7 | C22 | C23 | H27 | 142.6° | 120.2° |
| N7 | C22 | C23 | H28 | 96.1° | 117.7° |
| C22 | N7 | C25 | H29 | 109.9° | 79.2° |
| C22 | N7 | C25 | H30 | 127.3° | 157.6° |
| C23 | C24 | C25 | N7 | 23.4° | 37.5° |
| C23 | C24 | N26 | C25 | 118.6° | 113.5° |
| C23 | C24 | N26 | H16 | 117.6° | 123.3° |
| C23 | C24 | C25 | H16 | 117.5° | 118.6° |
| C23 | C24 | N26 | C30 | 150.1° | 91.5° |
| C24 | C23 | C22 | H14 | 142.1° | 118.2° |
| C24 | C23 | C22 | H15 | 95.5° | 120.6° |
| C23 | C24 | N26 | H17 | 29.9° | 88.5° |
| C24 | C23 | H27 | H28 | 121.9° | 122.2° |
| C23 | C24 | C25 | H29 | 95.3° | 81.0° |
| C23 | C24 | C25 | H30 | 142.0° | 155.8° |
| C4 | C5 | C6 | H24 | 180.0° | 179.8° |
| C5 | C4 | C3 | H23 | 180.0° | 180.0° |
| C4 | C5 | C6 | N7 | 179.5° | 180.0° |
| C4 | C5 | C6 | N1 | 1.9° | 0.3° |
| C5 | C4 | C3 | C27 | 176.3° | 180.0° |
| C5 | C4 | C3 | C2 | 2.2° | 0.0° |
| C6 | C5 | C4 | C3 | 2.2° | 0.2° |
| C5 | C6 | N7 | N1 | 177.7° | 179.7° |
| C5 | C6 | N7 | C25 | 171.8° | 167.2° |
| C5 | C6 | N1 | C2 | 1.4° | 0.1° |
| C6 | C5 | C4 | H23 | 177.7° | 179.7° |
| C4 | C3 | C27 | N28 | 16.1° | 5.9° |
| C4 | C3 | C27 | C2 | 178.5° | 180.0° |
| C4 | C3 | C27 | O29 | 166.6° | 174.1° |
| C4 | C3 | C2 | N1 | 1.6° | 0.3° |
| C4 | C3 | C2 | N8 | 179.8° | 180.0° |
| C3 | C4 | C5 | H24 | 177.8° | 180.0° |
| C6 | N7 | C25 | C24 | 169.0° | 159.7° |
| N7 | C6 | N1 | C2 | 179.1° | 179.8° |
| C6 | N7 | C22 | H14 | 54.4° | 26.4° |
| C6 | N7 | C22 | H15 | 67.9° | 94.8° |
| N7 | C6 | C5 | H24 | 0.6° | 0.2° |
| C6 | N7 | C25 | H29 | 72.3° | 41.3° |
| C6 | N7 | C25 | H30 | 50.4° | 81.9° |
| C25 | N7 | C6 | N1 | 6.0° | 12.5° |
| N7 | C25 | C24 | N26 | 94.8° | 155.8° |
| N7 | C25 | C24 | H29 | 118.7° | 118.5° |
| N7 | C25 | C24 | H30 | 118.6° | 118.4° |
| C25 | N7 | C22 | H14 | 127.8° | 94.1° |
| C25 | N7 | C22 | H15 | 109.8° | 144.7° |
| N7 | C25 | C24 | H16 | 140.9° | 81.1° |
| N7 | C25 | H29 | H30 | 123.9° | 123.0° |
| C6 | N1 | C2 | C3 | 1.2° | 0.2° |
| C6 | N1 | C2 | N8 | 179.3° | 179.9° |
| N1 | C6 | C5 | H24 | 178.1° | 179.9° |
| N26 | C24 | C25 | H16 | 124.3° | 123.1° |
| C24 | N26 | C30 | H17 | 180.0° | 180.0° |
| C24 | N26 | C30 | C32 | 176.3° | 180.0° |
| C24 | N26 | C30 | O31 | 1.0° | 0.0° |
| N26 | C24 | C23 | H27 | 24.3° | 21.4° |
| N26 | C24 | C23 | H28 | 145.6° | 100.8° |
| N26 | C24 | C25 | H29 | 146.5° | 37.4° |
| N26 | C24 | C25 | H30 | 23.8° | 85.8° |
| C25 | C24 | N26 | C30 | 91.3° | 155.0° |
| C25 | C24 | N26 | H17 | 88.7° | 25.0° |
| C25 | C24 | C23 | H27 | 149.1° | 97.0° |
| C25 | C24 | C23 | H28 | 89.5° | 140.8° |
| C24 | C25 | H29 | H30 | 123.8° | 123.1° |
| N26 | C30 | C32 | O31 | 177.6° | 179.9° |
| N26 | C30 | C32 | C33 | 148.0° | 179.9° |
| C30 | N26 | C24 | H16 | 32.5° | 31.9° |
| N26 | C30 | C32 | H18 | 32.0° | 0.1° |
| N28 | C27 | C3 | O29 | 177.4° | 180.0° |
| N28 | C27 | C3 | C2 | 162.4° | 174.1° |
| C27 | N28 | H31 | H32 | 180.0° | 179.9° |
| C27 | C3 | C2 | N1 | 176.8° | 179.7° |
| C27 | C3 | C2 | N8 | 1.3° | 0.0° |
| C27 | C3 | C4 | H23 | 3.7° | 0.0° |
| C3 | C27 | N28 | H31 | 177.3° | 0.0° |
| C3 | C27 | N28 | H32 | 2.7° | 180.0° |
| C2 | C3 | C27 | O29 | 14.9° | 6.0° |
| C3 | C2 | N1 | N8 | 178.1° | 179.7° |
| C3 | C2 | N8 | C9 | 177.2° | 173.9° |
| C2 | C3 | C4 | H23 | 177.8° | 180.0° |
| C3 | C2 | N8 | H25 | 2.8° | 6.1° |
| C30 | C32 | C33 | H18 | 180.0° | 180.0° |
| C32 | C30 | N26 | H17 | 3.6° | 0.1° |
| C30 | C32 | C33 | H20 | 180.0° | 179.9° |
| C30 | C32 | C33 | H21 | 0.0° | 0.0° |
| C33 | C32 | C30 | O31 | 34.4° | 0.0° |
| C32 | C33 | H20 | H21 | 180.0° | 179.9° |
| O31 | C30 | N26 | H17 | 179.0° | 180.0° |
| O31 | C30 | C32 | H18 | 145.7° | 180.0° |
| O29 | C27 | N28 | H31 | 0.0° | 180.0° |
| O29 | C27 | N28 | H32 | 180.0° | 0.1° |
| N1 | C2 | N8 | C9 | 4.7° | 5.8° |
| N1 | C2 | N8 | H25 | 175.2° | 174.2° |
| C2 | N8 | C9 | H25 | 180.0° | 180.0° |
| C2 | N8 | C9 | C14 | 4.2° | 35.1° |
| C2 | N8 | C9 | C10 | 179.1° | 144.6° |
| N8 | C9 | C14 | C10 | 176.6° | 179.7° |
| N8 | C9 | C14 | C13 | 178.1° | 179.7° |
| N8 | C9 | C10 | C11 | 176.9° | 179.7° |
| N8 | C9 | C10 | H1 | 3.1° | 0.3° |
| N8 | C9 | C14 | H4 | 2.0° | 0.3° |
| C9 | C14 | C13 | H4 | 180.0° | 180.0° |
| C9 | C14 | C13 | C12 | 0.4° | 0.1° |
| C14 | C9 | C10 | C11 | 0.0° | 0.0° |
| C14 | C9 | C10 | H1 | 180.0° | 179.9° |
| C9 | C14 | C13 | H3 | 179.6° | 180.0° |
| C14 | C9 | N8 | H25 | 175.8° | 144.9° |
| C13 | C14 | C9 | C10 | 1.4° | 0.0° |
| C14 | C13 | C12 | H3 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 2.0° | 0.1° |
| C14 | C13 | C12 | C15 | 176.1° | 180.0° |
| C9 | C10 | C11 | H1 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 2.3° | 0.0° |
| C9 | C10 | C11 | H2 | 177.7° | 180.0° |
| C10 | C9 | C14 | H4 | 178.6° | 180.0° |
| C10 | C9 | N8 | H25 | 0.9° | 35.4° |
| C13 | C12 | C11 | C10 | 3.3° | 0.0° |
| C13 | C12 | C11 | C15 | 173.6° | 180.0° |
| C13 | C12 | C15 | O17 | 26.2° | 180.0° |
| C13 | C12 | C15 | N16 | 145.4° | 0.0° |
| C13 | C12 | C11 | H2 | 176.7° | 180.0° |
| C12 | C13 | C14 | H4 | 179.6° | 180.0° |
| C10 | C11 | C12 | H2 | 180.0° | 180.0° |
| C10 | C11 | C12 | C15 | 177.0° | 180.0° |
| C11 | C12 | C15 | O17 | 159.9° | 0.0° |
| C11 | C12 | C15 | N16 | 28.5° | 180.0° |
| C12 | C11 | C10 | H1 | 177.7° | 180.0° |
| C11 | C12 | C13 | H3 | 178.0° | 180.0° |
| C12 | C15 | O17 | N16 | 171.2° | 180.0° |
| C12 | C15 | N16 | C18 | 177.0° | 180.0° |
| C15 | C12 | C11 | H2 | 3.0° | 0.0° |
| C15 | C12 | C13 | H3 | 3.9° | 0.0° |
| C12 | C15 | N16 | H26 | 3.0° | 0.0° |
| O17 | C15 | N16 | C18 | 6.1° | 0.0° |
| O17 | C15 | N16 | H26 | 173.9° | 180.0° |
| C15 | N16 | C18 | H26 | 180.0° | 180.0° |
| C15 | N16 | C18 | C21 | 63.5° | 60.0° |
| C15 | N16 | C18 | C19 | 58.7° | 60.0° |
| C15 | N16 | C18 | C20 | 179.5° | 180.0° |
| N16 | C18 | C21 | C19 | 123.2° | 120.0° |
| N16 | C18 | C21 | C20 | 117.5° | 120.0° |
| N16 | C18 | C19 | C20 | 120.3° | 120.0° |
| N16 | C18 | C19 | H5 | 180.0° | 180.0° |
| N16 | C18 | C19 | H6 | 60.0° | 60.0° |
| N16 | C18 | C19 | H7 | 60.0° | 60.0° |
| N16 | C18 | C20 | H8 | 180.0° | 60.0° |
| N16 | C18 | C20 | H9 | 60.0° | 60.0° |
| N16 | C18 | C20 | H10 | 60.0° | 180.0° |
| N16 | C18 | C21 | H11 | 180.0° | 60.0° |
| N16 | C18 | C21 | H12 | 60.0° | 180.0° |
| N16 | C18 | C21 | H13 | 60.0° | 60.0° |
| C21 | C18 | C19 | C20 | 118.3° | 120.0° |
| C21 | C18 | C19 | H5 | 58.6° | 60.0° |
| C21 | C18 | C19 | H6 | 61.4° | 180.0° |
| C21 | C18 | C19 | H7 | 178.6° | 60.0° |
| C21 | C18 | C20 | H8 | 62.2° | 60.0° |
| C21 | C18 | C20 | H9 | 177.7° | 180.0° |
| C21 | C18 | C20 | H10 | 57.8° | 60.0° |
| C18 | C21 | H11 | H12 | 120.0° | 120.0° |
| C18 | C21 | H11 | H13 | 120.0° | 120.0° |
| C18 | C21 | H12 | H13 | 120.0° | 120.0° |
| C21 | C18 | N16 | H26 | 116.5° | 120.0° |
| C18 | C19 | H5 | H6 | 120.0° | 120.0° |
| C18 | C19 | H5 | H7 | 120.0° | 120.0° |
| C18 | C19 | H6 | H7 | 120.0° | 119.9° |
| C19 | C18 | C20 | H8 | 57.6° | 180.0° |
| C19 | C18 | C20 | H9 | 62.4° | 60.0° |
| C19 | C18 | C20 | H10 | 177.6° | 60.0° |
| C19 | C18 | C21 | H11 | 56.8° | 180.0° |
| C19 | C18 | C21 | H12 | 176.9° | 60.0° |
| C19 | C18 | C21 | H13 | 63.2° | 60.0° |
| C19 | C18 | N16 | H26 | 121.3° | 120.0° |
| C20 | C18 | C19 | H5 | 59.7° | 59.9° |
| C20 | C18 | C19 | H6 | 179.7° | 60.1° |
| C20 | C18 | C19 | H7 | 60.3° | 180.0° |
| C18 | C20 | H8 | H9 | 120.0° | 120.0° |
| C18 | C20 | H8 | H10 | 120.0° | 120.0° |
| C18 | C20 | H9 | H10 | 120.0° | 120.1° |
| C20 | C18 | C21 | H11 | 62.5° | 60.0° |
| C20 | C18 | C21 | H12 | 57.5° | 60.0° |
| C20 | C18 | C21 | H13 | 177.5° | 180.0° |
| C20 | C18 | N16 | H26 | 0.4° | 0.0° |
| H1 | C10 | C11 | H2 | 2.3° | 0.1° |
| H3 | C13 | C14 | H4 | 0.4° | 0.0° |
| H5 | C19 | H6 | H7 | 120.0° | 120.1° |
| H8 | C20 | H9 | H10 | 120.0° | 119.9° |
| H11 | C21 | H12 | H13 | 120.0° | 120.0° |
| H14 | C22 | C23 | H27 | 98.6° | 0.8° |
| H14 | C22 | C23 | H28 | 22.7° | 123.0° |
| H15 | C22 | C23 | H27 | 23.8° | 120.5° |
| H15 | C22 | C23 | H28 | 145.1° | 1.7° |
| H16 | C24 | N26 | H17 | 147.5° | 148.2° |
| H16 | C24 | C23 | H27 | 93.7° | 144.5° |
| H16 | C24 | C23 | H28 | 27.7° | 22.3° |
| H16 | C24 | C25 | H29 | 22.2° | 160.4° |
| H16 | C24 | C25 | H30 | 100.5° | 37.3° |
| H18 | C32 | C33 | H20 | 0.0° | 0.1° |
| H18 | C32 | C33 | H21 | 180.0° | 180.0° |
| H23 | C4 | C5 | H24 | 2.2° | 0.0° |
