CTF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.39Å | 1.42Å | Aromatic |
| C1 | O3 | sing | 1.36Å | 1.42Å | |
| C1 | C6 | sing | 1.38Å | 1.42Å | Aromatic |
| O1 | S1 | doub | 1.42Å | 1.42Å | |
| O2 | S1 | doub | 1.42Å | 1.42Å | |
| C2 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C2 | O4 | sing | 1.36Å | 1.38Å | |
| C3 | C4 | doub | 1.39Å | 1.44Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.43Å | Aromatic |
| C4 | C8 | sing | 1.50Å | 1.53Å | |
| S1 | N1 | sing | 1.66Å | 1.58Å | |
| S1 | O3 | sing | 1.52Å | 1.59Å | |
| C5 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C5 | C11 | sing | 1.51Å | 1.53Å | |
| O4 | C7 | sing | 1.43Å | 1.42Å | |
| C8 | C9 | sing | 1.53Å | 1.58Å | |
| C8 | C12 | sing | 1.52Å | 1.56Å | |
| C9 | C10 | sing | 1.53Å | 1.54Å | |
| C9 | C15 | sing | 1.51Å | 1.56Å | |
| C10 | C11 | sing | 1.53Å | 1.56Å | |
| C12 | C13 | sing | 1.54Å | 1.56Å | |
| C13 | C14 | sing | 1.51Å | 1.52Å | |
| C14 | C15 | sing | 1.55Å | 1.58Å | |
| C14 | C16 | sing | 1.53Å | 1.55Å | |
| C14 | C17 | sing | 1.52Å | 1.57Å | |
| C15 | C19 | sing | 1.53Å | 1.55Å | |
| C17 | C18 | sing | 1.55Å | 1.51Å | |
| C17 | C20 | sing | 1.53Å | 1.51Å | |
| C18 | C19 | sing | 1.55Å | 1.54Å | |
| C20 | C21 | sing | 1.47Å | 1.49Å | |
| C21 | N2 | trip | 1.14Å | 1.14Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N1 | HN1A | sing | 0.97Å | 1.00Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C7 | H7B | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O3 | 119.2° | 120.2° |
| C2 | C1 | C6 | 120.3° | 119.7° |
| C1 | C2 | C3 | 117.9° | 119.5° |
| C1 | C2 | O4 | 126.0° | 120.2° |
| O3 | C1 | C6 | 120.5° | 120.2° |
| C1 | O3 | S1 | 124.6° | 114.0° |
| C1 | C6 | C5 | 121.0° | 120.7° |
| C1 | C6 | H6 | 119.5° | 119.6° |
| O1 | S1 | O2 | 121.3° | 123.1° |
| O1 | S1 | N1 | 108.7° | 106.4° |
| O1 | S1 | O3 | 104.2° | 106.4° |
| O2 | S1 | N1 | 109.4° | 106.4° |
| O2 | S1 | O3 | 106.7° | 106.4° |
| C3 | C2 | O4 | 116.2° | 120.3° |
| C2 | C3 | C4 | 123.5° | 120.7° |
| C2 | C3 | H3 | 118.3° | 119.7° |
| C2 | O4 | C7 | 120.0° | 117.0° |
| C3 | C4 | C5 | 116.9° | 119.9° |
| C3 | C4 | C8 | 121.3° | 118.2° |
| C4 | C3 | H3 | 118.3° | 119.7° |
| C5 | C4 | C8 | 121.7° | 121.9° |
| C4 | C5 | C6 | 120.5° | 119.6° |
| C4 | C5 | C11 | 121.1° | 122.9° |
| C4 | C8 | C9 | 112.7° | 110.0° |
| C4 | C8 | C12 | 111.8° | 111.8° |
| C4 | C8 | H8 | 106.5° | 108.0° |
| N1 | S1 | O3 | 105.4° | 107.2° |
| S1 | N1 | HN1 | 109.5° | 120.0° |
| S1 | N1 | HN1A | 109.4° | 120.0° |
| C6 | C5 | C11 | 118.4° | 117.5° |
| C5 | C6 | H6 | 119.5° | 119.7° |
| C5 | C11 | C10 | 115.0° | 111.2° |
| C5 | C11 | H11 | 107.7° | 109.1° |
| C5 | C11 | H11A | 106.4° | 109.2° |
| O4 | C7 | H7 | 109.5° | 109.5° |
| O4 | C7 | H7A | 109.4° | 109.5° |
| O4 | C7 | H7B | 109.5° | 109.5° |
| C9 | C8 | C12 | 112.4° | 111.4° |
| C8 | C9 | C10 | 108.9° | 107.9° |
| C8 | C9 | C15 | 105.2° | 107.1° |
| C9 | C8 | H8 | 105.9° | 108.0° |
| C8 | C9 | H9 | 115.7° | 109.7° |
| C8 | C12 | C13 | 113.2° | 110.7° |
| C12 | C8 | H8 | 107.0° | 107.4° |
| C8 | C12 | H12 | 108.3° | 109.2° |
| C8 | C12 | H12A | 107.4° | 109.3° |
| C10 | C9 | C15 | 117.2° | 111.9° |
| C9 | C10 | C11 | 111.2° | 108.2° |
| C10 | C9 | H9 | 103.3° | 109.7° |
| C9 | C10 | H10 | 108.9° | 109.7° |
| C9 | C10 | H10A | 108.5° | 109.7° |
| C9 | C15 | C14 | 115.6° | 106.4° |
| C9 | C15 | C19 | 119.2° | 116.0° |
| C15 | C9 | H9 | 107.1° | 110.5° |
| C9 | C15 | H15 | 95.3° | 110.4° |
| C11 | C10 | H10 | 108.9° | 109.7° |
| C11 | C10 | H10A | 108.5° | 109.7° |
| C10 | C11 | H11 | 107.7° | 109.1° |
| C10 | C11 | H11A | 106.4° | 109.1° |
| C12 | C13 | C14 | 113.2° | 107.7° |
| C13 | C12 | H12 | 108.2° | 109.2° |
| C13 | C12 | H12A | 107.4° | 109.3° |
| C12 | C13 | H13 | 108.3° | 109.8° |
| C12 | C13 | H13A | 107.4° | 109.9° |
| C13 | C14 | C15 | 108.8° | 108.0° |
| C13 | C14 | C16 | 108.6° | 109.6° |
| C13 | C14 | C17 | 116.7° | 116.9° |
| C14 | C13 | H13 | 108.2° | 109.8° |
| C14 | C13 | H13A | 107.4° | 109.8° |
| C15 | C14 | C16 | 115.1° | 109.6° |
| C15 | C14 | C17 | 94.2° | 103.3° |
| C14 | C15 | C19 | 102.3° | 101.6° |
| C14 | C15 | H15 | 114.5° | 110.6° |
| C16 | C14 | C17 | 113.1° | 109.1° |
| C14 | C16 | H16 | 109.5° | 109.5° |
| C14 | C16 | H16A | 109.5° | 109.4° |
| C14 | C16 | H16B | 109.4° | 109.5° |
| C14 | C17 | C18 | 104.2° | 105.3° |
| C14 | C17 | C20 | 114.4° | 110.3° |
| C14 | C17 | H17 | 109.6° | 110.3° |
| C15 | C19 | C18 | 104.5° | 103.0° |
| C19 | C15 | H15 | 110.5° | 111.3° |
| C15 | C19 | H19 | 111.2° | 110.7° |
| C15 | C19 | H19A | 112.3° | 110.7° |
| C18 | C17 | C20 | 108.8° | 110.2° |
| C17 | C18 | C19 | 104.6° | 106.3° |
| C18 | C17 | H17 | 115.1° | 110.3° |
| C17 | C18 | H18 | 111.1° | 110.0° |
| C17 | C18 | H18A | 112.1° | 110.1° |
| C17 | C20 | C21 | 113.0° | 109.5° |
| C20 | C17 | H17 | 105.0° | 110.3° |
| C17 | C20 | H20 | 108.3° | 109.5° |
| C17 | C20 | H20A | 107.5° | 109.5° |
| C19 | C18 | H18 | 111.1° | 110.1° |
| C19 | C18 | H18A | 112.2° | 110.1° |
| C18 | C19 | H19 | 111.2° | 110.7° |
| C18 | C19 | H19A | 112.2° | 110.7° |
| C20 | C21 | N2 | 177.4° | 180.0° |
| C21 | C20 | H20 | 108.3° | 109.5° |
| C21 | C20 | H20A | 107.5° | 109.5° |
| HN1 | N1 | HN1A | 109.5° | 120.0° |
| H7 | C7 | H7A | 109.5° | 109.5° |
| H7 | C7 | H7B | 109.4° | 109.5° |
| H7A | C7 | H7B | 109.5° | 109.4° |
| H10 | C10 | H10A | 110.8° | 109.8° |
| H11 | C11 | H11A | 113.9° | 109.1° |
| H12 | C12 | H12A | 112.4° | 109.2° |
| H13 | C13 | H13A | 112.5° | 109.9° |
| H16 | C16 | H16A | 109.4° | 109.5° |
| H16 | C16 | H16B | 109.5° | 109.5° |
| H16A | C16 | H16B | 109.5° | 109.5° |
| H18 | C18 | H18A | 105.8° | 110.1° |
| H19 | C19 | H19A | 105.7° | 110.8° |
| H20 | C20 | H20A | 112.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O3 | C6 | 178.6° | 179.7° |
| C1 | C2 | C3 | O4 | 179.6° | 179.9° |
| C1 | C2 | C3 | C4 | 0.0° | 0.0° |
| C2 | C1 | O3 | S1 | 69.3° | 90.0° |
| C2 | C1 | C6 | C5 | 0.2° | 0.6° |
| C1 | C2 | O4 | C7 | 100.0° | 180.0° |
| C1 | C2 | C3 | H3 | 179.9° | 180.0° |
| C2 | C1 | C6 | H6 | 179.8° | 180.0° |
| C1 | O3 | S1 | O1 | 99.5° | 38.5° |
| C1 | O3 | S1 | O2 | 29.9° | 171.4° |
| O3 | C1 | C2 | C3 | 178.2° | 179.9° |
| O3 | C1 | C2 | O4 | 1.4° | 0.2° |
| C1 | O3 | S1 | N1 | 146.1° | 75.0° |
| O3 | C1 | C6 | C5 | 178.4° | 179.7° |
| O3 | C1 | C6 | H6 | 1.6° | 0.2° |
| C6 | C1 | C2 | C3 | 0.4° | 0.1° |
| C6 | C1 | C2 | O4 | 180.0° | 180.0° |
| C1 | C6 | C5 | C4 | 0.4° | 0.9° |
| C6 | C1 | O3 | S1 | 112.1° | 89.8° |
| C1 | C6 | C5 | H6 | 180.0° | 179.5° |
| C1 | C6 | C5 | C11 | 179.3° | 178.8° |
| O1 | S1 | O2 | N1 | 127.7° | 122.9° |
| O1 | S1 | O2 | O3 | 118.8° | 123.0° |
| O1 | S1 | N1 | O3 | 111.2° | 113.6° |
| O1 | S1 | N1 | HN1 | 91.3° | 113.5° |
| O1 | S1 | N1 | HN1A | 148.6° | 66.4° |
| O2 | S1 | N1 | O3 | 114.4° | 113.5° |
| O2 | S1 | N1 | HN1 | 134.2° | 113.6° |
| O2 | S1 | N1 | HN1A | 14.2° | 66.5° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.6° | 0.4° |
| C2 | C3 | C4 | C8 | 178.2° | 179.0° |
| C3 | C2 | O4 | C7 | 80.4° | 0.1° |
| O4 | C2 | C3 | C4 | 179.6° | 180.0° |
| O4 | C2 | C3 | H3 | 0.4° | 0.1° |
| C2 | O4 | C7 | H7 | 91.1° | 60.1° |
| C2 | O4 | C7 | H7A | 28.9° | 60.0° |
| C2 | O4 | C7 | H7B | 148.9° | 179.9° |
| C3 | C4 | C5 | C8 | 178.8° | 179.4° |
| C3 | C4 | C5 | C6 | 0.8° | 0.8° |
| C3 | C4 | C5 | C11 | 179.6° | 178.8° |
| C3 | C4 | C8 | C9 | 160.2° | 159.1° |
| C3 | C4 | C8 | C12 | 32.4° | 34.7° |
| C3 | C4 | C8 | H8 | 84.1° | 83.3° |
| C4 | C5 | C6 | C11 | 178.9° | 179.7° |
| C5 | C4 | C8 | C9 | 21.1° | 21.6° |
| C5 | C4 | C8 | C12 | 148.8° | 145.9° |
| C4 | C5 | C11 | C10 | 11.2° | 15.7° |
| C5 | C4 | C3 | H3 | 179.4° | 179.7° |
| C4 | C5 | C6 | H6 | 179.6° | 179.6° |
| C5 | C4 | C8 | H8 | 94.6° | 96.1° |
| C4 | C5 | C11 | H11 | 108.8° | 104.7° |
| C4 | C5 | C11 | H11A | 128.8° | 136.1° |
| C8 | C4 | C5 | C6 | 178.0° | 178.5° |
| C8 | C4 | C5 | C11 | 0.9° | 1.8° |
| C4 | C8 | C9 | C12 | 127.5° | 124.6° |
| C4 | C8 | C9 | H8 | 116.1° | 117.7° |
| C4 | C8 | C12 | H8 | 116.2° | 118.4° |
| C4 | C8 | C9 | C10 | 50.8° | 54.8° |
| C4 | C8 | C9 | C15 | 177.1° | 175.4° |
| C4 | C8 | C12 | C13 | 178.2° | 179.5° |
| C8 | C4 | C3 | H3 | 1.9° | 0.9° |
| C4 | C8 | C9 | H9 | 64.9° | 64.7° |
| C4 | C8 | C12 | H12 | 58.2° | 60.2° |
| C4 | C8 | C12 | H12A | 63.5° | 59.1° |
| S1 | N1 | HN1 | HN1A | 120.0° | 180.0° |
| O3 | S1 | N1 | HN1 | 19.8° | 0.0° |
| O3 | S1 | N1 | HN1A | 100.2° | 180.0° |
| C6 | C5 | C11 | C10 | 167.7° | 164.7° |
| C6 | C5 | C11 | H11 | 72.3° | 74.9° |
| C6 | C5 | C11 | H11A | 50.1° | 44.2° |
| C5 | C11 | C10 | C9 | 42.2° | 48.8° |
| C5 | C11 | C10 | H11 | 120.0° | 120.4° |
| C5 | C11 | C10 | H11A | 117.6° | 120.5° |
| C11 | C5 | C6 | H6 | 0.7° | 0.7° |
| C5 | C11 | C10 | H10 | 77.8° | 70.9° |
| C5 | C11 | C10 | H10A | 161.5° | 168.4° |
| C5 | C11 | H11 | H11A | 117.8° | 119.2° |
| O4 | C7 | H7 | H7A | 120.0° | 120.1° |
| O4 | C7 | H7 | H7B | 120.0° | 120.0° |
| O4 | C7 | H7A | H7B | 120.0° | 120.0° |
| C9 | C8 | C12 | H8 | 115.8° | 118.0° |
| C8 | C9 | C10 | C15 | 119.1° | 117.5° |
| C8 | C9 | C10 | H9 | 123.4° | 119.5° |
| C8 | C9 | C15 | H9 | 123.6° | 119.4° |
| C8 | C9 | C10 | C11 | 61.7° | 70.2° |
| C9 | C8 | C12 | C13 | 53.9° | 55.9° |
| C8 | C9 | C15 | C14 | 59.4° | 65.2° |
| C8 | C9 | C15 | C19 | 178.0° | 177.3° |
| C8 | C9 | C10 | H10 | 58.3° | 49.5° |
| C8 | C9 | C10 | H10A | 179.1° | 170.1° |
| C9 | C8 | C12 | H12 | 173.9° | 176.2° |
| C9 | C8 | C12 | H12A | 64.5° | 64.4° |
| C8 | C9 | C15 | H15 | 61.0° | 54.9° |
| C12 | C8 | C9 | C10 | 178.2° | 179.3° |
| C12 | C8 | C9 | C15 | 55.4° | 60.0° |
| C8 | C12 | C13 | H12 | 120.0° | 120.3° |
| C8 | C12 | C13 | H12A | 118.4° | 120.4° |
| C8 | C12 | C13 | C14 | 51.2° | 57.0° |
| C12 | C8 | C9 | H9 | 62.5° | 59.9° |
| C8 | C12 | H12 | H12A | 118.5° | 119.4° |
| C8 | C12 | C13 | H13 | 68.8° | 62.5° |
| C8 | C12 | C13 | H13A | 169.5° | 176.6° |
| C10 | C9 | C15 | H9 | 115.3° | 122.5° |
| C9 | C10 | C11 | H10 | 120.0° | 119.7° |
| C9 | C10 | C11 | H10A | 119.3° | 119.7° |
| C10 | C9 | C15 | C14 | 179.5° | 176.8° |
| C10 | C9 | C15 | C19 | 57.0° | 64.7° |
| C10 | C9 | C8 | H8 | 65.3° | 62.9° |
| C9 | C10 | H10 | H10A | 119.3° | 120.6° |
| C9 | C10 | C11 | H11 | 77.8° | 71.6° |
| C9 | C10 | C11 | H11A | 159.8° | 169.3° |
| C10 | C9 | C15 | H15 | 60.1° | 63.1° |
| C15 | C9 | C10 | C11 | 179.2° | 172.3° |
| C9 | C15 | C14 | C13 | 58.3° | 69.3° |
| C9 | C15 | C14 | C19 | 131.2° | 121.8° |
| C9 | C15 | C14 | H15 | 109.4° | 119.9° |
| C9 | C15 | C14 | C16 | 63.7° | 50.0° |
| C9 | C15 | C14 | C17 | 178.4° | 166.2° |
| C9 | C15 | C19 | H15 | 108.8° | 127.4° |
| C9 | C15 | C19 | C18 | 162.5° | 156.5° |
| C15 | C9 | C8 | H8 | 61.0° | 57.7° |
| C15 | C9 | C10 | H10 | 60.8° | 68.1° |
| C15 | C9 | C10 | H10A | 59.9° | 52.6° |
| C9 | C15 | C19 | H19 | 42.5° | 38.1° |
| C9 | C15 | C19 | H19A | 75.7° | 85.2° |
| C11 | C10 | C9 | H9 | 61.8° | 49.3° |
| C11 | C10 | H10 | H10A | 119.3° | 120.6° |
| C10 | C11 | H11 | H11A | 117.7° | 119.1° |
| C12 | C13 | C14 | H13 | 120.0° | 119.5° |
| C12 | C13 | C14 | H13A | 118.4° | 119.6° |
| C12 | C13 | C14 | C15 | 50.6° | 63.7° |
| C12 | C13 | C14 | C16 | 75.3° | 55.7° |
| C12 | C13 | C14 | C17 | 155.6° | 179.6° |
| C13 | C12 | C8 | H8 | 61.9° | 62.1° |
| C13 | C12 | H12 | H12A | 118.5° | 119.4° |
| C12 | C13 | H13 | H13A | 118.5° | 121.0° |
| C13 | C14 | C15 | C16 | 122.1° | 119.3° |
| C13 | C14 | C15 | C17 | 120.0° | 124.5° |
| C13 | C14 | C16 | C17 | 131.1° | 129.2° |
| C13 | C14 | C15 | C19 | 170.5° | 168.9° |
| C13 | C14 | C17 | C18 | 164.6° | 147.8° |
| C13 | C14 | C17 | C20 | 76.7° | 93.3° |
| C14 | C13 | C12 | H12 | 171.2° | 177.3° |
| C14 | C13 | C12 | H12A | 67.2° | 63.3° |
| C14 | C13 | H13 | H13A | 118.4° | 120.9° |
| C13 | C14 | C15 | H15 | 51.0° | 50.7° |
| C13 | C14 | C16 | H16 | 179.5° | 55.9° |
| C13 | C14 | C16 | H16A | 60.5° | 175.9° |
| C13 | C14 | C16 | H16B | 59.5° | 64.1° |
| C13 | C14 | C17 | H17 | 40.9° | 28.8° |
| C15 | C14 | C16 | C17 | 106.7° | 112.5° |
| C14 | C15 | C19 | H15 | 122.3° | 117.8° |
| C15 | C14 | C17 | C18 | 51.1° | 29.3° |
| C15 | C14 | C17 | C20 | 169.8° | 148.2° |
| C14 | C15 | C19 | C18 | 33.5° | 41.6° |
| C14 | C15 | C9 | H9 | 64.2° | 54.3° |
| C15 | C14 | C13 | H13 | 69.4° | 55.9° |
| C15 | C14 | C13 | H13A | 169.0° | 176.8° |
| C15 | C14 | C16 | H16 | 57.3° | 62.4° |
| C15 | C14 | C16 | H16A | 177.3° | 57.5° |
| C15 | C14 | C16 | H16B | 62.7° | 177.6° |
| C15 | C14 | C17 | H17 | 72.6° | 89.7° |
| C14 | C15 | C19 | H19 | 86.5° | 76.7° |
| C14 | C15 | C19 | H19A | 155.4° | 160.0° |
| C16 | C14 | C15 | C19 | 67.4° | 71.8° |
| C16 | C14 | C17 | C18 | 68.4° | 87.2° |
| C16 | C14 | C17 | C20 | 50.3° | 31.7° |
| C16 | C14 | C13 | H13 | 164.7° | 175.2° |
| C16 | C14 | C13 | H13A | 43.1° | 63.9° |
| C16 | C14 | C15 | H15 | 173.1° | 170.0° |
| C14 | C16 | H16 | H16A | 120.0° | 119.9° |
| C14 | C16 | H16 | H16B | 120.0° | 120.0° |
| C14 | C16 | H16A | H16B | 120.0° | 120.0° |
| C16 | C14 | C17 | H17 | 167.9° | 153.8° |
| C17 | C14 | C15 | C19 | 50.5° | 44.4° |
| C14 | C17 | C18 | C20 | 122.5° | 118.9° |
| C14 | C17 | C18 | H17 | 120.0° | 119.0° |
| C14 | C17 | C20 | H17 | 120.2° | 122.1° |
| C14 | C17 | C18 | C19 | 32.5° | 3.5° |
| C14 | C17 | C20 | C21 | 86.5° | 175.0° |
| C17 | C14 | C13 | H13 | 35.6° | 60.0° |
| C17 | C14 | C13 | H13A | 86.1° | 60.9° |
| C17 | C14 | C15 | H15 | 69.0° | 73.8° |
| C17 | C14 | C16 | H16 | 49.4° | 174.9° |
| C17 | C14 | C16 | H16A | 70.6° | 54.9° |
| C17 | C14 | C16 | H16B | 169.4° | 65.1° |
| C14 | C17 | C18 | H18 | 152.5° | 122.7° |
| C14 | C17 | C18 | H18A | 89.3° | 115.8° |
| C14 | C17 | C20 | H20 | 33.5° | 55.0° |
| C14 | C17 | C20 | H20A | 155.0° | 65.0° |
| C15 | C19 | C18 | C17 | 0.8° | 24.0° |
| C15 | C19 | C18 | H19 | 120.0° | 118.4° |
| C15 | C19 | C18 | H19A | 121.9° | 118.4° |
| C19 | C15 | C9 | H9 | 58.4° | 57.8° |
| C15 | C19 | C18 | H18 | 119.2° | 95.2° |
| C15 | C19 | C18 | H18A | 122.6° | 143.3° |
| C15 | C19 | H19 | H19A | 122.0° | 123.3° |
| C18 | C17 | C20 | H17 | 123.8° | 122.1° |
| C17 | C18 | C19 | H18 | 120.0° | 119.2° |
| C17 | C18 | C19 | H18A | 121.8° | 119.3° |
| C18 | C17 | C20 | C21 | 157.4° | 69.1° |
| C17 | C18 | H18 | H18A | 121.9° | 121.6° |
| C17 | C18 | C19 | H19 | 119.2° | 94.4° |
| C17 | C18 | C19 | H19A | 122.7° | 142.4° |
| C18 | C17 | C20 | H20 | 82.6° | 170.9° |
| C18 | C17 | C20 | H20A | 38.9° | 50.9° |
| C20 | C17 | C18 | C19 | 155.0° | 122.4° |
| C17 | C20 | C21 | H20 | 120.0° | 120.0° |
| C17 | C20 | C21 | H20A | 118.5° | 120.0° |
| C17 | C20 | C21 | N2 | 102.5° | 88.3° |
| C20 | C17 | C18 | H18 | 85.0° | 118.4° |
| C20 | C17 | C18 | H18A | 33.2° | 3.2° |
| C17 | C20 | H20 | H20A | 118.6° | 120.0° |
| C18 | C19 | C15 | H15 | 88.8° | 76.2° |
| C19 | C18 | C17 | H17 | 87.5° | 115.5° |
| C19 | C18 | H18 | H18A | 122.0° | 121.5° |
| C18 | C19 | H19 | H19A | 122.0° | 123.2° |
| C21 | C20 | C17 | H17 | 33.7° | 52.9° |
| C21 | C20 | H20 | H20A | 118.6° | 120.0° |
| N2 | C21 | C20 | H20 | 17.5° | 31.7° |
| N2 | C21 | C20 | H20A | 139.0° | 151.7° |
| H7 | C7 | H7A | H7B | 120.0° | 120.0° |
| H8 | C8 | C9 | H9 | 179.0° | 177.6° |
| H8 | C8 | C12 | H12 | 58.1° | 58.2° |
| H8 | C8 | C12 | H12A | 179.7° | 177.5° |
| H9 | C9 | C10 | H10 | 178.2° | 169.0° |
| H9 | C9 | C10 | H10A | 57.5° | 70.4° |
| H9 | C9 | C15 | H15 | 175.4° | 174.4° |
| H10 | C10 | C11 | H11 | 162.2° | 168.7° |
| H10 | C10 | C11 | H11A | 39.8° | 49.6° |
| H10A | C10 | C11 | H11 | 41.5° | 48.1° |
| H10A | C10 | C11 | H11A | 80.9° | 71.0° |
| H12 | C12 | C13 | H13 | 51.2° | 57.8° |
| H12 | C12 | C13 | H13A | 70.5° | 63.1° |
| H12A | C12 | C13 | H13 | 172.8° | 177.2° |
| H12A | C12 | C13 | H13A | 51.2° | 56.2° |
| H15 | C15 | C19 | H19 | 151.2° | 165.5° |
| H15 | C15 | C19 | H19A | 33.1° | 42.2° |
| H16 | C16 | H16A | H16B | 120.0° | 120.1° |
| H17 | C17 | C18 | H18 | 32.5° | 3.7° |
| H17 | C17 | C18 | H18A | 150.7° | 125.2° |
| H17 | C17 | C20 | H20 | 153.6° | 67.1° |
| H17 | C17 | C20 | H20A | 84.8° | 172.9° |
| H18 | C18 | C19 | H19 | 120.8° | 146.4° |
| H18 | C18 | C19 | H19A | 2.7° | 23.2° |
| H18A | C18 | C19 | H19 | 2.6° | 24.9° |
| H18A | C18 | C19 | H19A | 115.5° | 98.3° |
