DJQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C4 | sing | 1.51Å | 1.45Å | |
| N8 | C4 | sing | 1.35Å | 1.42Å | Aromatic |
| N8 | C7 | doub | 1.31Å | 1.33Å | Aromatic |
| C4 | N5 | doub | 1.30Å | 1.35Å | Aromatic |
| C7 | C9 | sing | 1.51Å | 1.49Å | |
| C7 | O6 | sing | 1.34Å | 1.36Å | Aromatic |
| C9 | N10 | sing | 1.47Å | 1.45Å | |
| O37 | C11 | doub | 1.21Å | 1.22Å | |
| N5 | O6 | sing | 1.21Å | 1.32Å | Aromatic |
| N10 | C11 | sing | 1.35Å | 1.42Å | |
| N10 | C30 | sing | 1.47Å | 1.49Å | |
| C11 | C12 | sing | 1.51Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | N15 | sing | 1.47Å | 1.47Å | |
| C17 | C12 | sing | 1.53Å | 1.56Å | |
| C30 | N29 | sing | 1.48Å | 1.49Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C12 | N29 | sing | 1.48Å | 1.50Å | |
| N15 | C14 | sing | 1.47Å | 1.47Å | |
| N15 | C18 | sing | 1.35Å | 1.41Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| O28 | C18 | doub | 1.22Å | 1.25Å | |
| N29 | C31 | sing | 1.40Å | 1.47Å | |
| C18 | C19 | sing | 1.48Å | 1.50Å | |
| C20 | C19 | sing | 1.40Å | 1.41Å | Aromatic |
| C20 | C21 | doub | 1.36Å | 1.37Å | Aromatic |
| C19 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C31 | C36 | doub | 1.39Å | 1.40Å | Aromatic |
| C31 | C32 | sing | 1.39Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.40Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.40Å | 1.39Å | Aromatic |
| C32 | C33 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.41Å | 1.42Å | Aromatic |
| C22 | N27 | sing | 1.37Å | 1.38Å | Aromatic |
| C23 | C25 | sing | 1.46Å | 1.42Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| N27 | N26 | sing | 1.40Å | 1.36Å | Aromatic |
| C25 | N26 | doub | 1.30Å | 1.34Å | Aromatic |
| C13 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.08Å | 1.08Å | |
| C21 | H6 | sing | 1.08Å | 1.08Å | |
| C24 | H7 | sing | 1.08Å | 1.08Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H22 | sing | 1.09Å | 1.10Å | |
| C32 | H23 | sing | 1.08Å | 1.08Å | |
| C33 | H24 | sing | 1.08Å | 1.08Å | |
| C34 | H25 | sing | 1.08Å | 1.08Å | |
| C35 | H26 | sing | 1.08Å | 1.08Å | |
| C36 | H27 | sing | 1.08Å | 1.08Å | |
| N27 | H20 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C3 | 60.3° | 60.1° |
| C1 | C2 | C3 | 59.6° | 60.0° |
| C1 | C2 | C4 | 116.8° | 117.5° |
| C2 | C1 | H8 | 120.0° | 117.5° |
| C2 | C1 | H9 | 120.0° | 117.5° |
| C1 | C2 | H10 | 116.7° | 117.5° |
| C1 | C3 | C2 | 60.1° | 60.0° |
| C3 | C1 | H8 | 120.0° | 117.5° |
| C3 | C1 | H9 | 119.9° | 117.5° |
| C1 | C3 | H11 | 120.0° | 117.5° |
| C1 | C3 | H12 | 120.0° | 117.5° |
| C3 | C2 | C4 | 115.7° | 117.5° |
| C3 | C2 | H10 | 116.7° | 117.5° |
| C2 | C3 | H11 | 120.0° | 117.5° |
| C2 | C3 | H12 | 120.0° | 117.5° |
| C2 | C4 | N8 | 124.4° | 126.3° |
| C2 | C4 | N5 | 124.5° | 126.3° |
| C4 | C2 | H10 | 118.2° | 115.6° |
| C4 | N8 | C7 | 101.9° | 105.6° |
| N8 | C4 | N5 | 111.0° | 107.4° |
| N8 | C7 | C9 | 129.3° | 126.5° |
| N8 | C7 | O6 | 112.3° | 106.9° |
| C4 | N5 | O6 | 106.3° | 110.3° |
| C9 | C7 | O6 | 118.4° | 126.6° |
| C7 | C9 | N10 | 115.6° | 109.5° |
| C7 | C9 | H13 | 107.9° | 109.5° |
| C7 | C9 | H14 | 107.9° | 109.5° |
| C7 | O6 | N5 | 108.5° | 109.8° |
| C9 | N10 | C11 | 127.9° | 125.3° |
| C9 | N10 | C30 | 120.2° | 125.2° |
| N10 | C9 | H13 | 107.9° | 109.4° |
| N10 | C9 | H14 | 107.9° | 109.5° |
| O37 | C11 | N10 | 124.3° | 125.8° |
| O37 | C11 | C12 | 127.6° | 125.8° |
| C11 | N10 | C30 | 111.9° | 109.6° |
| N10 | C11 | C12 | 108.1° | 108.4° |
| N10 | C30 | N29 | 102.5° | 106.2° |
| N10 | C30 | H21 | 111.2° | 110.1° |
| N10 | C30 | H22 | 111.2° | 110.1° |
| C11 | C12 | C17 | 108.5° | 110.4° |
| C11 | C12 | C13 | 112.0° | 110.4° |
| C11 | C12 | N29 | 101.9° | 105.2° |
| C17 | C16 | N15 | 108.9° | 108.7° |
| C16 | C17 | C12 | 113.4° | 109.4° |
| C16 | C17 | H3 | 108.5° | 109.5° |
| C16 | C17 | H4 | 108.5° | 109.5° |
| C17 | C16 | H17 | 109.6° | 109.7° |
| C17 | C16 | H18 | 109.6° | 109.6° |
| C16 | N15 | C14 | 113.8° | 118.8° |
| C16 | N15 | C18 | 121.7° | 120.6° |
| N15 | C16 | H17 | 109.6° | 109.6° |
| N15 | C16 | H18 | 109.6° | 109.6° |
| C17 | C12 | C13 | 113.2° | 110.6° |
| C17 | C12 | N29 | 112.8° | 110.0° |
| C12 | C17 | H3 | 108.5° | 109.5° |
| C12 | C17 | H4 | 108.5° | 109.5° |
| C30 | N29 | C12 | 110.3° | 103.1° |
| C30 | N29 | C31 | 120.5° | 111.0° |
| N29 | C30 | H21 | 111.2° | 110.1° |
| N29 | C30 | H22 | 111.1° | 110.1° |
| C13 | C12 | N29 | 108.0° | 110.0° |
| C12 | C13 | C14 | 113.9° | 109.4° |
| C12 | C13 | H1 | 108.4° | 109.5° |
| C12 | C13 | H2 | 108.3° | 109.5° |
| C12 | N29 | C31 | 124.4° | 111.0° |
| C14 | N15 | C18 | 124.4° | 120.6° |
| N15 | C14 | C13 | 111.5° | 108.7° |
| N15 | C14 | H15 | 109.0° | 109.6° |
| N15 | C14 | H16 | 109.0° | 109.7° |
| N15 | C18 | O28 | 118.9° | 120.0° |
| N15 | C18 | C19 | 121.0° | 120.0° |
| C14 | C13 | H1 | 108.3° | 109.4° |
| C14 | C13 | H2 | 108.4° | 109.5° |
| C13 | C14 | H15 | 108.9° | 109.6° |
| C13 | C14 | H16 | 109.0° | 109.6° |
| O28 | C18 | C19 | 120.0° | 120.0° |
| N29 | C31 | C36 | 114.6° | 120.1° |
| N29 | C31 | C32 | 125.5° | 120.1° |
| C18 | C19 | C20 | 116.2° | 120.0° |
| C18 | C19 | C24 | 122.4° | 119.9° |
| C19 | C20 | C21 | 122.0° | 120.7° |
| C20 | C19 | C24 | 121.3° | 120.1° |
| C19 | C20 | H5 | 119.0° | 119.6° |
| C20 | C21 | C22 | 116.8° | 120.2° |
| C21 | C20 | H5 | 119.0° | 119.6° |
| C20 | C21 | H6 | 121.6° | 119.9° |
| C19 | C24 | C23 | 117.4° | 119.5° |
| C19 | C24 | H7 | 121.3° | 120.3° |
| C36 | C31 | C32 | 119.9° | 119.8° |
| C31 | C36 | C35 | 119.2° | 119.9° |
| C31 | C36 | H27 | 120.4° | 120.0° |
| C31 | C32 | C33 | 120.5° | 119.9° |
| C31 | C32 | H23 | 119.7° | 120.0° |
| C21 | C22 | C23 | 122.2° | 119.7° |
| C21 | C22 | N27 | 131.6° | 133.5° |
| C22 | C21 | H6 | 121.6° | 119.9° |
| C36 | C35 | C34 | 120.3° | 120.1° |
| C36 | C35 | H26 | 119.9° | 120.0° |
| C35 | C36 | H27 | 120.4° | 120.1° |
| C24 | C23 | C22 | 120.2° | 119.8° |
| C24 | C23 | C25 | 134.6° | 133.9° |
| C23 | C24 | H7 | 121.3° | 120.2° |
| C32 | C33 | C34 | 119.2° | 120.1° |
| C33 | C32 | H23 | 119.7° | 120.0° |
| C32 | C33 | H24 | 120.4° | 120.0° |
| C23 | C22 | N27 | 106.1° | 106.7° |
| C22 | C23 | C25 | 105.1° | 106.3° |
| C22 | N27 | N26 | 111.0° | 109.2° |
| C22 | N27 | H20 | 124.5° | 125.4° |
| C23 | C25 | N26 | 110.1° | 107.7° |
| C23 | C25 | H19 | 125.0° | 126.2° |
| C35 | C34 | C33 | 121.0° | 120.2° |
| C35 | C34 | H25 | 119.5° | 119.9° |
| C34 | C35 | H26 | 119.8° | 119.9° |
| C34 | C33 | H24 | 120.4° | 119.9° |
| C33 | C34 | H25 | 119.5° | 120.0° |
| N27 | N26 | C25 | 107.7° | 110.1° |
| N26 | N27 | H20 | 124.5° | 125.4° |
| N26 | C25 | H19 | 124.9° | 126.1° |
| H1 | C13 | H2 | 109.5° | 109.5° |
| H3 | C17 | H4 | 109.5° | 109.5° |
| H8 | C1 | H9 | 109.5° | 115.5° |
| H11 | C3 | H12 | 109.5° | 115.6° |
| H13 | C9 | H14 | 109.5° | 109.5° |
| H15 | C14 | H16 | 109.5° | 109.6° |
| H17 | C16 | H18 | 109.4° | 109.7° |
| H21 | C30 | H22 | 109.5° | 110.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C3 | H8 | 109.6° | 107.5° |
| C2 | C1 | C3 | H9 | 109.6° | 107.5° |
| C1 | C2 | C3 | C4 | 107.2° | 107.5° |
| C1 | C2 | C3 | H10 | 106.8° | 107.5° |
| C1 | C2 | C4 | H10 | 147.3° | 145.7° |
| C1 | C2 | C4 | N8 | 96.8° | 119.8° |
| C1 | C2 | C4 | N5 | 80.7° | 60.0° |
| C2 | C1 | H8 | H9 | 144.6° | 145.7° |
| C2 | C1 | C3 | H11 | 109.5° | 107.4° |
| C2 | C1 | C3 | H12 | 109.5° | 107.4° |
| C3 | C1 | H8 | H9 | 144.5° | 145.7° |
| C1 | C3 | H11 | H12 | 144.7° | 145.8° |
| C3 | C2 | C4 | H10 | 145.4° | 145.7° |
| C3 | C2 | C4 | N8 | 164.1° | 171.6° |
| C3 | C2 | C4 | N5 | 13.4° | 8.6° |
| C2 | C3 | H11 | H12 | 144.7° | 145.7° |
| C2 | C4 | N8 | N5 | 177.8° | 179.8° |
| C2 | C4 | N8 | C7 | 177.4° | 179.9° |
| C2 | C4 | N5 | O6 | 177.5° | 180.0° |
| C4 | C2 | C1 | H8 | 144.9° | 145.0° |
| C4 | C2 | C1 | H9 | 4.0° | 0.0° |
| C4 | C2 | C3 | H11 | 143.3° | 145.0° |
| C4 | C2 | C3 | H12 | 2.2° | 0.0° |
| C4 | N8 | C7 | C9 | 178.6° | 179.8° |
| C4 | N8 | C7 | O6 | 0.3° | 0.4° |
| N8 | C4 | N5 | O6 | 0.4° | 0.2° |
| N8 | C4 | C2 | H10 | 50.4° | 26.0° |
| C7 | N8 | C4 | N5 | 0.4° | 0.4° |
| N8 | C7 | C9 | O6 | 178.9° | 179.8° |
| N8 | C7 | C9 | N10 | 166.1° | 90.3° |
| N8 | C7 | O6 | N5 | 0.1° | 0.3° |
| N8 | C7 | C9 | H13 | 73.0° | 149.8° |
| N8 | C7 | C9 | H14 | 45.1° | 29.7° |
| C4 | N5 | O6 | C7 | 0.2° | 0.0° |
| N5 | C4 | C2 | H10 | 132.0° | 154.3° |
| C7 | C9 | N10 | H13 | 120.9° | 120.0° |
| C7 | C9 | N10 | H14 | 120.9° | 120.0° |
| C9 | C7 | O6 | N5 | 179.0° | 179.9° |
| C7 | C9 | N10 | C11 | 83.7° | 90.0° |
| C7 | C9 | N10 | C30 | 94.6° | 90.0° |
| C7 | C9 | H13 | H14 | 117.2° | 120.0° |
| O6 | C7 | C9 | N10 | 15.1° | 89.9° |
| O6 | C7 | C9 | H13 | 105.8° | 30.0° |
| O6 | C7 | C9 | H14 | 136.0° | 150.0° |
| C9 | N10 | C11 | O37 | 3.8° | 0.6° |
| C9 | N10 | C11 | C30 | 178.4° | 180.0° |
| C9 | N10 | C11 | C12 | 176.5° | 179.4° |
| C9 | N10 | C30 | N29 | 169.3° | 162.5° |
| N10 | C9 | H13 | H14 | 117.2° | 120.0° |
| C9 | N10 | C30 | H21 | 71.8° | 78.3° |
| C9 | N10 | C30 | H22 | 50.5° | 43.4° |
| O37 | C11 | N10 | C12 | 179.7° | 180.0° |
| O37 | C11 | N10 | C30 | 174.6° | 179.4° |
| O37 | C11 | C12 | C17 | 78.1° | 77.8° |
| O37 | C11 | C12 | C13 | 47.5° | 44.9° |
| O37 | C11 | C12 | N29 | 162.7° | 163.6° |
| N10 | C11 | C12 | C17 | 102.1° | 102.3° |
| C11 | N10 | C30 | N29 | 9.2° | 17.5° |
| N10 | C11 | C12 | C13 | 132.2° | 135.1° |
| N10 | C11 | C12 | N29 | 17.0° | 16.4° |
| C11 | N10 | C9 | H13 | 37.2° | 30.0° |
| C11 | N10 | C9 | H14 | 155.4° | 150.0° |
| C11 | N10 | C30 | H21 | 109.7° | 101.7° |
| C11 | N10 | C30 | H22 | 128.0° | 136.7° |
| C30 | N10 | C11 | C12 | 5.1° | 0.6° |
| N10 | C30 | N29 | H21 | 118.9° | 119.2° |
| N10 | C30 | N29 | H22 | 118.9° | 119.2° |
| N10 | C30 | N29 | C12 | 20.7° | 26.6° |
| N10 | C30 | N29 | C31 | 177.1° | 145.5° |
| C30 | N10 | C9 | H13 | 144.6° | 150.0° |
| C30 | N10 | C9 | H14 | 26.3° | 30.0° |
| N10 | C30 | H21 | H22 | 123.2° | 121.7° |
| C11 | C12 | C17 | C16 | 81.4° | 62.2° |
| C11 | C12 | C17 | C13 | 125.0° | 122.5° |
| C11 | C12 | C17 | N29 | 112.1° | 115.7° |
| C11 | C12 | N29 | C30 | 23.5° | 25.9° |
| C11 | C12 | C13 | N29 | 111.4° | 115.7° |
| C11 | C12 | C13 | C14 | 82.2° | 62.3° |
| C11 | C12 | N29 | C31 | 178.7° | 144.8° |
| C11 | C12 | C13 | H1 | 157.2° | 177.8° |
| C11 | C12 | C13 | H2 | 38.4° | 57.7° |
| C11 | C12 | C17 | H3 | 158.0° | 57.7° |
| C11 | C12 | C17 | H4 | 39.1° | 177.7° |
| C17 | C16 | N15 | H17 | 119.9° | 119.8° |
| C17 | C16 | N15 | H18 | 119.9° | 119.7° |
| C16 | C17 | C12 | H3 | 120.6° | 119.9° |
| C16 | C17 | C12 | H4 | 120.6° | 120.0° |
| C16 | C17 | C12 | C13 | 43.5° | 60.3° |
| C16 | C17 | C12 | N29 | 166.4° | 177.9° |
| C17 | C16 | N15 | C14 | 61.5° | 54.1° |
| C17 | C16 | N15 | C18 | 115.6° | 125.9° |
| C16 | C17 | H3 | H4 | 118.2° | 120.1° |
| C17 | C16 | H17 | H18 | 120.2° | 120.4° |
| N15 | C16 | C17 | C12 | 52.4° | 54.0° |
| C16 | N15 | C14 | C18 | 176.9° | 180.0° |
| C16 | N15 | C14 | C13 | 59.9° | 54.0° |
| C16 | N15 | C18 | O28 | 11.3° | 174.6° |
| C16 | N15 | C18 | C19 | 171.1° | 5.4° |
| N15 | C16 | C17 | H3 | 68.2° | 173.9° |
| N15 | C16 | C17 | H4 | 172.9° | 66.0° |
| C16 | N15 | C14 | H15 | 60.4° | 173.8° |
| C16 | N15 | C14 | H16 | 179.8° | 65.8° |
| N15 | C16 | H17 | H18 | 120.3° | 120.4° |
| C17 | C12 | N29 | C30 | 92.7° | 93.0° |
| C17 | C12 | C13 | N29 | 125.5° | 121.8° |
| C17 | C12 | C13 | C14 | 40.9° | 60.3° |
| C17 | C12 | N29 | C31 | 62.6° | 25.9° |
| C17 | C12 | C13 | H1 | 79.8° | 59.7° |
| C17 | C12 | C13 | H2 | 161.5° | 179.8° |
| C12 | C17 | H3 | H4 | 118.3° | 120.1° |
| C12 | C17 | C16 | H17 | 67.6° | 65.8° |
| C12 | C17 | C16 | H18 | 172.3° | 173.7° |
| C30 | N29 | C12 | C13 | 141.5° | 144.9° |
| C30 | N29 | C12 | C31 | 155.3° | 118.9° |
| C30 | N29 | C31 | C36 | 29.1° | 171.7° |
| C30 | N29 | C31 | C32 | 153.1° | 8.6° |
| N29 | C30 | H21 | H22 | 123.2° | 121.6° |
| C12 | C13 | C14 | N15 | 48.0° | 53.9° |
| C12 | C13 | C14 | H1 | 120.6° | 120.0° |
| C12 | C13 | C14 | H2 | 120.6° | 120.0° |
| C13 | C12 | N29 | C31 | 63.2° | 96.2° |
| C12 | C13 | H1 | H2 | 118.0° | 120.1° |
| C13 | C12 | C17 | H3 | 77.1° | 179.8° |
| C13 | C12 | C17 | H4 | 164.1° | 59.7° |
| C12 | C13 | C14 | H15 | 72.3° | 173.7° |
| C12 | C13 | C14 | H16 | 168.3° | 66.0° |
| N29 | C12 | C13 | C14 | 166.4° | 177.9° |
| C12 | N29 | C31 | C36 | 178.0° | 57.7° |
| C12 | N29 | C31 | C32 | 0.1° | 122.6° |
| N29 | C12 | C13 | H1 | 45.8° | 62.1° |
| N29 | C12 | C13 | H2 | 72.9° | 58.0° |
| N29 | C12 | C17 | H3 | 45.9° | 58.0° |
| N29 | C12 | C17 | H4 | 73.0° | 62.1° |
| C12 | N29 | C30 | H21 | 98.2° | 92.5° |
| C12 | N29 | C30 | H22 | 139.5° | 145.8° |
| N15 | C14 | C13 | H15 | 120.3° | 119.8° |
| N15 | C14 | C13 | H16 | 120.3° | 119.9° |
| C14 | N15 | C18 | O28 | 172.0° | 5.4° |
| C14 | N15 | C18 | C19 | 5.6° | 174.6° |
| N15 | C14 | C13 | H1 | 72.7° | 66.0° |
| N15 | C14 | C13 | H2 | 168.6° | 173.9° |
| N15 | C14 | H15 | H16 | 119.1° | 120.5° |
| C14 | N15 | C16 | H17 | 58.5° | 65.8° |
| C14 | N15 | C16 | H18 | 178.6° | 173.8° |
| C18 | N15 | C14 | C13 | 117.1° | 125.9° |
| N15 | C18 | O28 | C19 | 177.6° | 180.0° |
| N15 | C18 | C19 | C20 | 125.9° | 146.7° |
| N15 | C18 | C19 | C24 | 54.9° | 33.3° |
| C18 | N15 | C14 | H15 | 122.6° | 6.2° |
| C18 | N15 | C14 | H16 | 3.3° | 114.2° |
| C18 | N15 | C16 | H17 | 124.5° | 114.3° |
| C18 | N15 | C16 | H18 | 4.4° | 6.2° |
| C14 | C13 | H1 | H2 | 118.0° | 120.0° |
| C13 | C14 | H15 | H16 | 119.1° | 120.3° |
| O28 | C18 | C19 | C20 | 51.6° | 33.3° |
| O28 | C18 | C19 | C24 | 127.6° | 146.7° |
| N29 | C31 | C36 | C32 | 178.0° | 179.7° |
| N29 | C31 | C36 | C35 | 177.3° | 179.7° |
| N29 | C31 | C32 | C33 | 177.4° | 180.0° |
| C31 | N29 | C30 | H21 | 58.2° | 26.4° |
| C31 | N29 | C30 | H22 | 64.1° | 95.3° |
| N29 | C31 | C32 | H23 | 2.7° | 0.1° |
| N29 | C31 | C36 | H27 | 2.7° | 0.0° |
| C18 | C19 | C20 | C24 | 179.2° | 179.9° |
| C18 | C19 | C20 | C21 | 179.5° | 180.0° |
| C18 | C19 | C24 | C23 | 179.8° | 180.0° |
| C18 | C19 | C20 | H5 | 0.5° | 0.2° |
| C18 | C19 | C24 | H7 | 0.2° | 0.0° |
| C19 | C20 | C21 | H5 | 180.0° | 179.8° |
| C19 | C20 | C21 | C22 | 0.3° | 0.0° |
| C20 | C19 | C24 | C23 | 1.0° | 0.1° |
| C19 | C20 | C21 | H6 | 179.7° | 180.0° |
| C20 | C19 | C24 | H7 | 179.0° | 179.9° |
| C21 | C20 | C19 | C24 | 0.3° | 0.1° |
| C20 | C21 | C22 | H6 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C20 | C21 | C22 | N27 | 176.9° | 180.0° |
| C19 | C24 | C23 | H7 | 180.0° | 180.0° |
| C19 | C24 | C23 | C22 | 1.1° | 0.0° |
| C19 | C24 | C23 | C25 | 176.0° | 180.0° |
| C24 | C19 | C20 | H5 | 179.7° | 179.7° |
| C31 | C36 | C35 | H27 | 180.0° | 179.7° |
| C36 | C31 | C32 | C33 | 0.4° | 0.3° |
| C31 | C36 | C35 | C34 | 0.4° | 0.6° |
| C36 | C31 | C32 | H23 | 179.6° | 179.8° |
| C31 | C36 | C35 | H26 | 179.6° | 179.7° |
| C32 | C31 | C36 | C35 | 0.7° | 0.6° |
| C31 | C32 | C33 | H23 | 180.0° | 179.9° |
| C31 | C32 | C33 | C34 | 0.3° | 0.0° |
| C31 | C32 | C33 | H24 | 179.7° | 180.0° |
| C32 | C31 | C36 | H27 | 179.3° | 179.7° |
| C21 | C22 | C23 | C24 | 0.6° | 0.0° |
| C21 | C22 | C23 | N27 | 177.7° | 180.0° |
| C21 | C22 | C23 | C25 | 177.3° | 180.0° |
| C21 | C22 | N27 | N26 | 176.9° | 180.0° |
| C22 | C21 | C20 | H5 | 179.7° | 179.8° |
| C21 | C22 | N27 | H20 | 3.1° | 0.0° |
| C36 | C35 | C34 | H26 | 180.0° | 179.7° |
| C36 | C35 | C34 | C33 | 0.3° | 0.3° |
| C36 | C35 | C34 | H25 | 179.7° | 179.7° |
| C24 | C23 | C22 | C25 | 177.9° | 179.9° |
| C24 | C23 | C22 | N27 | 178.2° | 180.0° |
| C24 | C23 | C25 | N26 | 177.6° | 180.0° |
| C24 | C23 | C25 | H19 | 2.4° | 0.1° |
| C32 | C33 | C34 | C35 | 0.7° | 0.0° |
| C32 | C33 | C34 | H24 | 180.0° | 180.0° |
| C32 | C33 | C34 | H25 | 179.4° | 180.0° |
| C23 | C22 | N27 | N26 | 0.4° | 0.0° |
| C22 | C23 | C25 | N26 | 0.2° | 0.1° |
| C23 | C22 | C21 | H6 | 179.9° | 180.0° |
| C22 | C23 | C24 | H7 | 178.9° | 180.0° |
| C22 | C23 | C25 | H19 | 179.9° | 180.0° |
| C23 | C22 | N27 | H20 | 179.5° | 180.0° |
| N27 | C22 | C23 | C25 | 0.4° | 0.0° |
| C22 | N27 | N26 | H20 | 180.0° | 180.0° |
| C22 | N27 | N26 | C25 | 0.3° | 0.0° |
| N27 | C22 | C21 | H6 | 3.1° | 0.0° |
| C23 | C25 | N26 | N27 | 0.1° | 0.1° |
| C23 | C25 | N26 | H19 | 180.0° | 179.9° |
| C25 | C23 | C24 | H7 | 4.0° | 0.0° |
| C35 | C34 | C33 | H25 | 180.0° | 180.0° |
| C35 | C34 | C33 | H24 | 179.3° | 180.0° |
| C34 | C35 | C36 | H27 | 179.6° | 179.8° |
| C34 | C33 | C32 | H23 | 179.7° | 179.9° |
| C33 | C34 | C35 | H26 | 179.7° | 180.0° |
| N27 | N26 | C25 | H19 | 179.9° | 180.0° |
| C25 | N26 | N27 | H20 | 179.6° | 180.0° |
| H1 | C13 | C14 | H15 | 167.0° | 53.7° |
| H1 | C13 | C14 | H16 | 47.6° | 174.0° |
| H2 | C13 | C14 | H15 | 48.3° | 66.3° |
| H2 | C13 | C14 | H16 | 71.1° | 54.0° |
| H3 | C17 | C16 | H17 | 171.8° | 54.1° |
| H3 | C17 | C16 | H18 | 51.7° | 66.4° |
| H4 | C17 | C16 | H17 | 53.0° | 174.2° |
| H4 | C17 | C16 | H18 | 67.1° | 53.7° |
| H5 | C20 | C21 | H6 | 0.3° | 0.2° |
| H8 | C1 | C2 | H10 | 2.9° | 0.1° |
| H8 | C1 | C3 | H11 | 0.0° | 0.1° |
| H8 | C1 | C3 | H12 | 140.9° | 145.0° |
| H9 | C1 | C2 | H10 | 143.8° | 145.1° |
| H9 | C1 | C3 | H11 | 140.9° | 145.1° |
| H9 | C1 | C3 | H12 | 0.1° | 0.1° |
| H10 | C2 | C3 | H11 | 2.7° | 0.0° |
| H10 | C2 | C3 | H12 | 143.7° | 145.1° |
| H23 | C32 | C33 | H24 | 0.3° | 0.1° |
| H24 | C33 | C34 | H25 | 0.6° | 0.0° |
| H25 | C34 | C35 | H26 | 0.3° | 0.0° |
| H26 | C35 | C36 | H27 | 0.4° | 0.0° |
