J48
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C18 | doub | 1.36Å | 1.36Å | Aromatic |
| C17 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| O28 | C26 | doub | 1.21Å | 1.21Å | |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | doub | 1.40Å | 1.42Å | Aromatic |
| C11 | C16 | sing | 1.37Å | 1.36Å | Aromatic |
| C12 | C13 | sing | 1.42Å | 1.41Å | Aromatic |
| C26 | N25 | sing | 1.35Å | 1.35Å | |
| C26 | O27 | sing | 1.34Å | 1.35Å | |
| C31 | C37 | sing | 1.53Å | 1.51Å | |
| C31 | O27 | sing | 1.45Å | 1.46Å | |
| C19 | N25 | sing | 1.40Å | 1.40Å | |
| C19 | N20 | doub | 1.32Å | 1.33Å | Aromatic |
| C16 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C37 | C33 | sing | 1.51Å | 1.52Å | |
| C13 | N20 | sing | 1.34Å | 1.37Å | Aromatic |
| C13 | N14 | doub | 1.34Å | 1.37Å | Aromatic |
| C15 | N14 | sing | 1.31Å | 1.34Å | Aromatic |
| C15 | C36 | sing | 1.50Å | 1.51Å | |
| C33 | C32 | doub | 1.31Å | 1.36Å | |
| C32 | C30 | sing | 1.51Å | 1.53Å | |
| C36 | N35 | sing | 1.47Å | 1.46Å | |
| N35 | C34 | sing | 1.47Å | 1.46Å | |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| O23 | C29 | sing | 1.46Å | 1.46Å | |
| O23 | C22 | sing | 1.34Å | 1.36Å | |
| C34 | C6 | sing | 1.50Å | 1.51Å | |
| N21 | C22 | sing | 1.36Å | 1.35Å | |
| N21 | C8 | sing | 1.41Å | 1.40Å | |
| N1 | C6 | doub | 1.31Å | 1.33Å | Aromatic |
| N1 | C2 | sing | 1.34Å | 1.37Å | Aromatic |
| N7 | C8 | doub | 1.32Å | 1.32Å | Aromatic |
| N7 | C2 | sing | 1.34Å | 1.36Å | Aromatic |
| C22 | O24 | doub | 1.21Å | 1.21Å | |
| C6 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | C3 | doub | 1.42Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.37Å | 1.36Å | Aromatic |
| C9 | C10 | doub | 1.37Å | 1.36Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.41Å | Aromatic |
| C3 | C10 | sing | 1.41Å | 1.42Å | Aromatic |
| C9 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C18 | H8 | sing | 1.08Å | 1.08Å | |
| C29 | H9 | sing | 1.09Å | 1.10Å | |
| C29 | H10 | sing | 1.09Å | 1.10Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| C30 | H12 | sing | 1.09Å | 1.10Å | |
| C31 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.09Å | 1.10Å | |
| C32 | H15 | sing | 1.08Å | 1.08Å | |
| C33 | H16 | sing | 1.08Å | 1.08Å | |
| C34 | H17 | sing | 1.09Å | 1.10Å | |
| C34 | H18 | sing | 1.09Å | 1.10Å | |
| C36 | H19 | sing | 1.09Å | 1.10Å | |
| C36 | H20 | sing | 1.09Å | 1.10Å | |
| C37 | H21 | sing | 1.09Å | 1.10Å | |
| C37 | H22 | sing | 1.09Å | 1.10Å | |
| N21 | H23 | sing | 0.97Å | 1.00Å | |
| N25 | H24 | sing | 0.97Å | 1.00Å | |
| N35 | H25 | sing | 1.01Å | 1.00Å | |
| N35 | H26 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | C12 | 120.5° | 118.6° |
| C17 | C18 | C19 | 117.9° | 119.5° |
| C18 | C17 | H7 | 119.7° | 120.7° |
| C17 | C18 | H8 | 121.1° | 120.3° |
| C17 | C12 | C11 | 125.6° | 121.8° |
| C17 | C12 | C13 | 117.1° | 119.2° |
| C12 | C17 | H7 | 119.8° | 120.7° |
| O28 | C26 | N25 | 126.5° | 118.3° |
| O28 | C26 | O27 | 125.1° | 118.3° |
| C18 | C19 | N25 | 123.3° | 121.2° |
| C18 | C19 | N20 | 124.3° | 121.9° |
| C19 | C18 | H8 | 121.0° | 120.2° |
| C12 | C11 | C16 | 120.1° | 118.1° |
| C11 | C12 | C13 | 117.3° | 119.0° |
| C12 | C11 | H3 | 119.9° | 121.0° |
| C11 | C16 | C15 | 119.2° | 120.1° |
| C16 | C11 | H3 | 120.0° | 120.9° |
| C11 | C16 | H6 | 120.4° | 120.0° |
| C12 | C13 | N20 | 122.1° | 119.6° |
| C12 | C13 | N14 | 122.3° | 119.9° |
| N25 | C26 | O27 | 108.4° | 123.5° |
| C26 | N25 | C19 | 128.1° | 116.7° |
| C26 | N25 | H24 | 115.9° | 121.6° |
| C26 | O27 | C31 | 116.0° | 115.6° |
| C37 | C31 | O27 | 113.3° | 110.3° |
| C31 | C37 | C33 | 115.4° | 109.5° |
| C37 | C31 | H13 | 108.5° | 109.3° |
| C37 | C31 | H14 | 108.5° | 109.3° |
| C31 | C37 | H21 | 107.9° | 109.5° |
| C31 | C37 | H22 | 108.0° | 109.5° |
| O27 | C31 | H13 | 108.5° | 109.3° |
| O27 | C31 | H14 | 108.5° | 109.3° |
| N25 | C19 | N20 | 112.4° | 116.9° |
| C19 | N25 | H24 | 116.0° | 121.7° |
| C19 | N20 | C13 | 117.9° | 121.2° |
| C16 | C15 | N14 | 123.2° | 121.5° |
| C16 | C15 | C36 | 122.1° | 118.7° |
| C15 | C16 | H6 | 120.4° | 119.9° |
| C37 | C33 | C32 | 125.5° | 120.3° |
| C37 | C33 | H16 | 117.2° | 119.7° |
| C33 | C37 | H21 | 108.0° | 109.4° |
| C33 | C37 | H22 | 108.0° | 109.4° |
| N20 | C13 | N14 | 115.6° | 120.5° |
| C13 | N14 | C15 | 118.0° | 121.2° |
| N14 | C15 | C36 | 114.7° | 119.8° |
| C15 | C36 | N35 | 108.7° | 111.2° |
| C15 | C36 | H19 | 109.7° | 109.1° |
| C15 | C36 | H20 | 109.7° | 109.2° |
| C33 | C32 | C30 | 127.8° | 120.3° |
| C33 | C32 | H15 | 116.1° | 120.0° |
| C32 | C33 | H16 | 117.2° | 120.0° |
| C32 | C30 | C29 | 115.1° | 109.5° |
| C32 | C30 | H11 | 108.1° | 109.5° |
| C32 | C30 | H12 | 108.0° | 109.4° |
| C30 | C32 | H15 | 116.1° | 119.7° |
| C36 | N35 | C34 | 115.3° | 109.0° |
| N35 | C36 | H19 | 109.6° | 109.1° |
| N35 | C36 | H20 | 109.6° | 109.2° |
| C36 | N35 | H25 | 108.0° | 109.6° |
| C36 | N35 | H26 | 108.0° | 109.6° |
| N35 | C34 | C6 | 109.4° | 111.7° |
| N35 | C34 | H17 | 109.5° | 109.1° |
| N35 | C34 | H18 | 109.5° | 109.0° |
| C34 | N35 | H25 | 108.0° | 109.5° |
| C34 | N35 | H26 | 108.0° | 109.5° |
| C30 | C29 | O23 | 112.5° | 110.5° |
| C30 | C29 | H9 | 108.7° | 109.3° |
| C30 | C29 | H10 | 108.7° | 109.2° |
| C29 | C30 | H11 | 108.0° | 109.5° |
| C29 | C30 | H12 | 108.0° | 109.5° |
| C29 | O23 | C22 | 116.4° | 115.7° |
| O23 | C29 | H9 | 108.7° | 109.3° |
| O23 | C29 | H10 | 108.7° | 109.3° |
| O23 | C22 | N21 | 109.2° | 122.5° |
| O23 | C22 | O24 | 125.1° | 118.8° |
| C34 | C6 | N1 | 115.2° | 119.8° |
| C34 | C6 | C5 | 121.4° | 118.7° |
| C6 | C34 | H17 | 109.5° | 109.0° |
| C6 | C34 | H18 | 109.5° | 109.1° |
| C22 | N21 | C8 | 126.6° | 114.0° |
| N21 | C22 | O24 | 125.7° | 118.8° |
| C22 | N21 | H23 | 116.7° | 123.0° |
| N21 | C8 | N7 | 112.1° | 117.3° |
| N21 | C8 | C9 | 123.4° | 120.7° |
| C8 | N21 | H23 | 116.7° | 122.9° |
| C6 | N1 | C2 | 117.7° | 121.4° |
| N1 | C6 | C5 | 123.3° | 121.5° |
| N1 | C2 | N7 | 115.3° | 120.8° |
| N1 | C2 | C3 | 122.4° | 119.9° |
| C8 | N7 | C2 | 117.9° | 121.3° |
| N7 | C8 | C9 | 124.4° | 122.0° |
| N7 | C2 | C3 | 122.2° | 119.3° |
| C6 | C5 | C4 | 119.4° | 119.9° |
| C6 | C5 | H4 | 120.3° | 120.0° |
| C8 | C9 | C10 | 117.9° | 119.5° |
| C8 | C9 | H1 | 121.1° | 120.3° |
| C2 | C3 | C4 | 117.0° | 118.8° |
| C2 | C3 | C10 | 117.5° | 119.4° |
| C5 | C4 | C3 | 120.1° | 118.2° |
| C4 | C5 | H4 | 120.3° | 120.0° |
| C5 | C4 | H5 | 120.0° | 120.9° |
| C9 | C10 | C3 | 120.2° | 118.3° |
| C10 | C9 | H1 | 121.1° | 120.2° |
| C9 | C10 | H2 | 119.9° | 120.9° |
| C4 | C3 | C10 | 125.5° | 121.7° |
| C3 | C4 | H5 | 119.9° | 120.9° |
| C3 | C10 | H2 | 119.9° | 120.8° |
| H9 | C29 | H10 | 109.4° | 109.3° |
| H11 | C30 | H12 | 109.5° | 109.4° |
| H13 | C31 | H14 | 109.4° | 109.2° |
| H17 | C34 | H18 | 109.5° | 109.0° |
| H19 | C36 | H20 | 109.5° | 109.0° |
| H21 | C37 | H22 | 109.5° | 109.5° |
| H25 | N35 | H26 | 109.5° | 109.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | C12 | H7 | 180.0° | 180.0° |
| C17 | C18 | C19 | H8 | 180.0° | 180.0° |
| C18 | C17 | C12 | C11 | 180.0° | 179.2° |
| C18 | C17 | C12 | C13 | 0.7° | 1.3° |
| C17 | C18 | C19 | N25 | 177.6° | 178.5° |
| C17 | C18 | C19 | N20 | 1.4° | 1.5° |
| C12 | C17 | C18 | C19 | 0.9° | 0.8° |
| C17 | C12 | C11 | C13 | 179.3° | 179.4° |
| C17 | C12 | C11 | C16 | 177.7° | 176.6° |
| C17 | C12 | C13 | N20 | 2.0° | 2.9° |
| C17 | C12 | C13 | N14 | 177.5° | 176.4° |
| C17 | C12 | C11 | H3 | 2.4° | 3.3° |
| C12 | C17 | C18 | H8 | 179.1° | 179.2° |
| O28 | C26 | N25 | O27 | 179.8° | 179.9° |
| O28 | C26 | O27 | C31 | 8.7° | 7.4° |
| O28 | C26 | N25 | C19 | 0.2° | 0.3° |
| O28 | C26 | N25 | H24 | 179.8° | 179.6° |
| C18 | C19 | N25 | C26 | 5.1° | 174.5° |
| C18 | C19 | N25 | N20 | 179.1° | 180.0° |
| C18 | C19 | N20 | C13 | 0.2° | 0.1° |
| C19 | C18 | C17 | H7 | 179.1° | 179.2° |
| C18 | C19 | N25 | H24 | 175.0° | 5.5° |
| C12 | C11 | C16 | H3 | 180.0° | 180.0° |
| C12 | C11 | C16 | C15 | 0.3° | 0.6° |
| C11 | C12 | C13 | N20 | 178.6° | 177.6° |
| C11 | C12 | C13 | N14 | 1.8° | 3.0° |
| C12 | C11 | C16 | H6 | 179.7° | 179.4° |
| C11 | C12 | C17 | H7 | 0.0° | 0.8° |
| C16 | C11 | C12 | C13 | 1.7° | 2.8° |
| C11 | C16 | C15 | H6 | 180.0° | 180.0° |
| C11 | C16 | C15 | N14 | 1.0° | 1.5° |
| C11 | C16 | C15 | C36 | 177.1° | 178.3° |
| C12 | C13 | N20 | C19 | 1.6° | 2.3° |
| C12 | C13 | N20 | N14 | 179.6° | 179.3° |
| C12 | C13 | N14 | C15 | 0.7° | 1.0° |
| C13 | C12 | C11 | H3 | 178.3° | 177.3° |
| C13 | C12 | C17 | H7 | 179.3° | 178.7° |
| N25 | C26 | O27 | C31 | 171.1° | 172.6° |
| C26 | N25 | C19 | H24 | 180.0° | 179.9° |
| C26 | N25 | C19 | N20 | 175.8° | 5.6° |
| C26 | O27 | C31 | C37 | 125.2° | 144.9° |
| O27 | C26 | N25 | C19 | 179.6° | 179.6° |
| C26 | O27 | C31 | H13 | 114.2° | 94.8° |
| C26 | O27 | C31 | H14 | 4.7° | 24.7° |
| O27 | C26 | N25 | H24 | 0.4° | 0.5° |
| C37 | C31 | O27 | H13 | 120.6° | 120.2° |
| C37 | C31 | O27 | H14 | 120.6° | 120.3° |
| C31 | C37 | C33 | H21 | 120.8° | 120.0° |
| C31 | C37 | C33 | H22 | 120.9° | 120.0° |
| C31 | C37 | C33 | C32 | 131.7° | 70.0° |
| C37 | C31 | H13 | H14 | 118.2° | 119.6° |
| C31 | C37 | C33 | H16 | 48.4° | 110.0° |
| C31 | C37 | H21 | H22 | 117.3° | 120.0° |
| O27 | C31 | C37 | C33 | 50.3° | 145.8° |
| O27 | C31 | H13 | H14 | 118.3° | 119.6° |
| O27 | C31 | C37 | H21 | 70.6° | 94.3° |
| O27 | C31 | C37 | H22 | 171.2° | 25.8° |
| N25 | C19 | N20 | C13 | 178.9° | 179.8° |
| N25 | C19 | C18 | H8 | 2.4° | 1.4° |
| C19 | N20 | C13 | N14 | 178.0° | 177.0° |
| N20 | C19 | C18 | H8 | 178.6° | 178.5° |
| N20 | C19 | N25 | H24 | 4.1° | 174.5° |
| C16 | C15 | N14 | C13 | 0.8° | 1.3° |
| C16 | C15 | N14 | C36 | 178.2° | 179.8° |
| C16 | C15 | C36 | N35 | 150.4° | 165.8° |
| C15 | C16 | C11 | H3 | 179.6° | 179.4° |
| C16 | C15 | C36 | H19 | 89.7° | 73.8° |
| C16 | C15 | C36 | H20 | 30.5° | 45.3° |
| C37 | C33 | C32 | H16 | 180.0° | 179.9° |
| C37 | C33 | C32 | C30 | 179.9° | 179.9° |
| C33 | C37 | C31 | H13 | 70.3° | 94.0° |
| C33 | C37 | C31 | H14 | 170.9° | 25.5° |
| C37 | C33 | C32 | H15 | 0.1° | 0.2° |
| C33 | C37 | H21 | H22 | 117.3° | 120.0° |
| N20 | C13 | N14 | C15 | 179.8° | 179.7° |
| C13 | N14 | C15 | C36 | 177.4° | 178.5° |
| N14 | C15 | C36 | N35 | 27.8° | 14.4° |
| N14 | C15 | C16 | H6 | 179.0° | 178.5° |
| N14 | C15 | C36 | H19 | 92.1° | 106.0° |
| N14 | C15 | C36 | H20 | 147.7° | 134.9° |
| C15 | C36 | N35 | H19 | 119.9° | 120.4° |
| C15 | C36 | N35 | H20 | 119.9° | 120.5° |
| C15 | C36 | N35 | C34 | 144.2° | 143.8° |
| C36 | C15 | C16 | H6 | 2.9° | 1.7° |
| C15 | C36 | H19 | H20 | 120.4° | 119.2° |
| C15 | C36 | N35 | H25 | 95.0° | 96.3° |
| C15 | C36 | N35 | H26 | 23.3° | 24.1° |
| C33 | C32 | C30 | H15 | 180.0° | 179.9° |
| C33 | C32 | C30 | C29 | 142.5° | 58.3° |
| C33 | C32 | C30 | H11 | 96.7° | 61.8° |
| C33 | C32 | C30 | H12 | 21.7° | 178.3° |
| C32 | C33 | C37 | H21 | 10.8° | 50.0° |
| C32 | C33 | C37 | H22 | 107.5° | 170.0° |
| C32 | C30 | C29 | H11 | 120.8° | 120.1° |
| C32 | C30 | C29 | H12 | 120.8° | 120.0° |
| C32 | C30 | C29 | O23 | 62.1° | 144.3° |
| C32 | C30 | C29 | H9 | 58.3° | 95.4° |
| C32 | C30 | C29 | H10 | 177.4° | 24.1° |
| C32 | C30 | H11 | H12 | 117.4° | 120.0° |
| C30 | C32 | C33 | H16 | 0.1° | 0.2° |
| C36 | N35 | C34 | H25 | 120.8° | 119.9° |
| C36 | N35 | C34 | H26 | 120.8° | 119.8° |
| C36 | N35 | C34 | C6 | 155.9° | 149.5° |
| C36 | N35 | C34 | H17 | 35.9° | 89.9° |
| C36 | N35 | C34 | H18 | 84.1° | 29.0° |
| N35 | C36 | H19 | H20 | 120.3° | 119.1° |
| C36 | N35 | H25 | H26 | 117.4° | 120.3° |
| N35 | C34 | C6 | H17 | 120.0° | 120.6° |
| N35 | C34 | C6 | H18 | 120.0° | 120.5° |
| N35 | C34 | C6 | N1 | 6.5° | 41.7° |
| N35 | C34 | C6 | C5 | 176.3° | 140.6° |
| N35 | C34 | H17 | H18 | 120.0° | 118.9° |
| C34 | N35 | C36 | H19 | 24.3° | 95.7° |
| C34 | N35 | C36 | H20 | 95.9° | 23.3° |
| C34 | N35 | H25 | H26 | 117.4° | 120.2° |
| C30 | C29 | O23 | H9 | 120.4° | 120.3° |
| C30 | C29 | O23 | H10 | 120.5° | 120.1° |
| C30 | C29 | O23 | C22 | 103.3° | 143.0° |
| C30 | C29 | H9 | H10 | 118.6° | 119.4° |
| C29 | C30 | H11 | H12 | 117.4° | 119.9° |
| C29 | C30 | C32 | H15 | 37.5° | 121.6° |
| C29 | O23 | C22 | N21 | 176.9° | 170.7° |
| C29 | O23 | C22 | O24 | 3.5° | 9.3° |
| O23 | C29 | H9 | H10 | 118.6° | 119.5° |
| O23 | C29 | C30 | H11 | 177.0° | 95.6° |
| O23 | C29 | C30 | H12 | 58.7° | 24.3° |
| O23 | C22 | N21 | O24 | 179.6° | 180.0° |
| O23 | C22 | N21 | C8 | 179.4° | 177.9° |
| C22 | O23 | C29 | H9 | 136.2° | 96.6° |
| C22 | O23 | C29 | H10 | 17.2° | 22.9° |
| O23 | C22 | N21 | H23 | 0.6° | 2.2° |
| C34 | C6 | N1 | C5 | 177.2° | 177.7° |
| C34 | C6 | N1 | C2 | 175.0° | 174.5° |
| C34 | C6 | C5 | C4 | 175.0° | 174.5° |
| C34 | C6 | C5 | H4 | 5.0° | 5.4° |
| C6 | C34 | H17 | H18 | 120.1° | 118.9° |
| C6 | C34 | N35 | H25 | 83.3° | 29.6° |
| C6 | C34 | N35 | H26 | 35.0° | 90.7° |
| C22 | N21 | C8 | H23 | 180.0° | 180.0° |
| C22 | N21 | C8 | N7 | 177.9° | 8.3° |
| C22 | N21 | C8 | C9 | 0.1° | 172.0° |
| N21 | C8 | N7 | C9 | 177.7° | 179.7° |
| N21 | C8 | N7 | C2 | 177.1° | 179.5° |
| C8 | N21 | C22 | O24 | 1.0° | 2.1° |
| N21 | C8 | C9 | C10 | 177.2° | 177.1° |
| N21 | C8 | C9 | H1 | 2.8° | 2.9° |
| C6 | N1 | C2 | N7 | 178.5° | 179.3° |
| C6 | N1 | C2 | C3 | 0.4° | 0.9° |
| N1 | C6 | C5 | C4 | 2.0° | 3.3° |
| N1 | C6 | C5 | H4 | 178.0° | 176.8° |
| N1 | C6 | C34 | H17 | 113.5° | 78.9° |
| N1 | C6 | C34 | H18 | 126.5° | 162.2° |
| N1 | C2 | N7 | C8 | 178.1° | 176.4° |
| N1 | C2 | N7 | C3 | 178.8° | 179.8° |
| C2 | N1 | C6 | C5 | 2.2° | 3.2° |
| N1 | C2 | C3 | C4 | 1.6° | 4.8° |
| N1 | C2 | C3 | C10 | 178.3° | 174.7° |
| C8 | N7 | C2 | C3 | 0.7° | 3.3° |
| N7 | C8 | C9 | C10 | 0.3° | 3.2° |
| N7 | C8 | C9 | H1 | 179.7° | 176.8° |
| N7 | C8 | N21 | H23 | 2.1° | 171.7° |
| C2 | N7 | C8 | C9 | 0.6° | 0.8° |
| N7 | C2 | C3 | C4 | 179.7° | 175.4° |
| N7 | C2 | C3 | C10 | 0.5° | 5.1° |
| O24 | C22 | N21 | H23 | 179.0° | 177.9° |
| C6 | C5 | C4 | H4 | 180.0° | 179.9° |
| C6 | C5 | C4 | C3 | 0.1° | 0.7° |
| C6 | C5 | C4 | H5 | 179.9° | 179.3° |
| C5 | C6 | C34 | H17 | 63.8° | 98.8° |
| C5 | C6 | C34 | H18 | 56.3° | 20.1° |
| C8 | C9 | C10 | H1 | 180.0° | 180.0° |
| C8 | C9 | C10 | C3 | 0.0° | 1.3° |
| C8 | C9 | C10 | H2 | 180.0° | 178.9° |
| C9 | C8 | N21 | H23 | 179.9° | 8.1° |
| C2 | C3 | C4 | C5 | 1.8° | 4.6° |
| C2 | C3 | C10 | C9 | 0.1° | 2.7° |
| C2 | C3 | C4 | C10 | 179.9° | 179.5° |
| C2 | C3 | C10 | H2 | 179.9° | 177.2° |
| C2 | C3 | C4 | H5 | 178.2° | 175.5° |
| C5 | C4 | C3 | H5 | 180.0° | 180.0° |
| C5 | C4 | C3 | C10 | 178.1° | 174.9° |
| C9 | C10 | C3 | C4 | 180.0° | 177.8° |
| C9 | C10 | C3 | H2 | 180.0° | 179.9° |
| C4 | C3 | C10 | H2 | 0.0° | 2.3° |
| C3 | C4 | C5 | H4 | 179.9° | 179.2° |
| C3 | C10 | C9 | H1 | 179.9° | 178.7° |
| C10 | C3 | C4 | H5 | 1.9° | 5.0° |
| H1 | C9 | C10 | H2 | 0.1° | 1.1° |
| H3 | C11 | C16 | H6 | 0.3° | 0.6° |
| H4 | C5 | C4 | H5 | 0.1° | 0.8° |
| H7 | C17 | C18 | H8 | 0.9° | 0.8° |
| H9 | C29 | C30 | H11 | 62.5° | 24.7° |
| H9 | C29 | C30 | H12 | 179.2° | 144.6° |
| H10 | C29 | C30 | H11 | 56.6° | 144.2° |
| H10 | C29 | C30 | H12 | 61.8° | 95.9° |
| H11 | C30 | C32 | H15 | 83.3° | 118.3° |
| H12 | C30 | C32 | H15 | 158.3° | 1.6° |
| H13 | C31 | C37 | H21 | 168.9° | 26.0° |
| H13 | C31 | C37 | H22 | 50.6° | 146.0° |
| H14 | C31 | C37 | H21 | 50.0° | 145.5° |
| H14 | C31 | C37 | H22 | 68.2° | 94.5° |
| H15 | C32 | C33 | H16 | 179.9° | 179.7° |
| H16 | C33 | C37 | H21 | 169.2° | 130.1° |
| H16 | C33 | C37 | H22 | 72.5° | 10.0° |
| H17 | C34 | N35 | H25 | 156.8° | 150.2° |
| H17 | C34 | N35 | H26 | 84.9° | 29.9° |
| H18 | C34 | N35 | H25 | 36.7° | 90.9° |
| H18 | C34 | N35 | H26 | 155.0° | 148.8° |
| H19 | C36 | N35 | H25 | 145.1° | 24.1° |
| H19 | C36 | N35 | H26 | 96.6° | 144.5° |
| H20 | C36 | N35 | H25 | 24.9° | 143.1° |
| H20 | C36 | N35 | H26 | 143.2° | 96.5° |
