C5M
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O2 | sing | 1.43Å | 1.44Å | |
| C1 | H1C1 | sing | 1.09Å | 1.10Å | |
| C1 | H1C2 | sing | 1.09Å | 1.10Å | |
| C1 | H1C3 | sing | 1.09Å | 1.10Å | |
| O2 | C3 | sing | 1.36Å | 1.36Å | |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | C6 | sing | 1.51Å | 1.52Å | |
| C5 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | H6C1 | sing | 1.09Å | 1.10Å | |
| C6 | H6C2 | sing | 1.09Å | 1.10Å | |
| C6 | H6C3 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | S12 | sing | 1.76Å | 1.79Å | |
| C8 | C9 | sing | 1.51Å | 1.51Å | |
| C8 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | H9C1 | sing | 1.09Å | 1.10Å | |
| C9 | H9C2 | sing | 1.09Å | 1.10Å | |
| C9 | H9C3 | sing | 1.09Å | 1.10Å | |
| C10 | C11 | sing | 1.51Å | 1.51Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H113 | sing | 1.09Å | 1.10Å | |
| S12 | O13 | doub | 1.42Å | 1.43Å | |
| S12 | O14 | doub | 1.42Å | 1.42Å | |
| S12 | N15 | sing | 1.66Å | 1.65Å | |
| N15 | C16 | sing | 1.46Å | 1.47Å | |
| N15 | H15 | sing | 0.97Å | 1.00Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | O18 | sing | 1.43Å | 1.43Å | |
| C17 | C19 | sing | 1.53Å | 1.54Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O18 | H18 | sing | 0.97Å | 0.95Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C19 | N27 | sing | 1.47Å | 1.47Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| N27 | C28 | sing | 1.47Å | 1.50Å | |
| N27 | H27 | sing | 1.01Å | 1.00Å | |
| C28 | C29 | sing | 1.51Å | 1.50Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | CL34 | sing | 1.74Å | 1.76Å | |
| C33 | C35 | doub | 1.38Å | 1.41Å | Aromatic |
| C35 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C1 | H1C1 | 109.5° | 109.4° |
| O2 | C1 | H1C2 | 109.4° | 109.5° |
| O2 | C1 | H1C3 | 109.5° | 109.5° |
| C1 | O2 | C3 | 109.5° | 106.8° |
| H1C1 | C1 | H1C2 | 109.5° | 109.5° |
| H1C1 | C1 | H1C3 | 109.5° | 109.5° |
| H1C2 | C1 | H1C3 | 109.5° | 109.5° |
| O2 | C3 | C4 | 120.7° | 120.1° |
| O2 | C3 | C10 | 119.7° | 120.1° |
| C4 | C3 | C10 | 119.6° | 119.9° |
| C3 | C4 | C5 | 121.7° | 120.0° |
| C3 | C4 | H4 | 119.1° | 120.0° |
| C3 | C10 | C8 | 119.5° | 119.9° |
| C3 | C10 | C11 | 119.5° | 120.0° |
| C5 | C4 | H4 | 119.1° | 120.0° |
| C4 | C5 | C6 | 116.2° | 120.0° |
| C4 | C5 | C7 | 119.4° | 120.1° |
| C6 | C5 | C7 | 124.3° | 119.9° |
| C5 | C6 | H6C1 | 109.5° | 109.5° |
| C5 | C6 | H6C2 | 109.5° | 109.5° |
| C5 | C6 | H6C3 | 109.5° | 109.4° |
| C5 | C7 | C8 | 118.4° | 120.1° |
| C5 | C7 | S12 | 122.4° | 120.0° |
| H6C1 | C6 | H6C2 | 109.5° | 109.5° |
| H6C1 | C6 | H6C3 | 109.5° | 109.5° |
| H6C2 | C6 | H6C3 | 109.4° | 109.5° |
| C8 | C7 | S12 | 119.2° | 120.0° |
| C7 | C8 | C9 | 120.5° | 119.9° |
| C7 | C8 | C10 | 121.4° | 120.1° |
| C7 | S12 | O13 | 106.9° | 105.7° |
| C7 | S12 | O14 | 107.5° | 105.8° |
| C7 | S12 | N15 | 108.3° | 107.4° |
| C9 | C8 | C10 | 118.1° | 120.0° |
| C8 | C9 | H9C1 | 109.5° | 109.5° |
| C8 | C9 | H9C2 | 109.4° | 109.4° |
| C8 | C9 | H9C3 | 109.5° | 109.5° |
| C8 | C10 | C11 | 121.0° | 120.0° |
| H9C1 | C9 | H9C2 | 109.5° | 109.4° |
| H9C1 | C9 | H9C3 | 109.4° | 109.4° |
| H9C2 | C9 | H9C3 | 109.5° | 109.5° |
| C10 | C11 | H111 | 109.4° | 109.5° |
| C10 | C11 | H112 | 109.5° | 109.5° |
| C10 | C11 | H113 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.4° |
| H111 | C11 | H113 | 109.5° | 109.5° |
| H112 | C11 | H113 | 109.5° | 109.4° |
| O13 | S12 | O14 | 123.6° | 125.4° |
| O13 | S12 | N15 | 104.3° | 105.8° |
| O14 | S12 | N15 | 105.5° | 105.8° |
| S12 | N15 | C16 | 121.8° | 120.0° |
| S12 | N15 | H15 | 105.5° | 120.0° |
| C16 | N15 | H15 | 105.6° | 120.0° |
| N15 | C16 | C17 | 110.2° | 109.5° |
| N15 | C16 | H161 | 109.1° | 109.5° |
| N15 | C16 | H162 | 109.2° | 109.5° |
| C17 | C16 | H161 | 109.1° | 109.5° |
| C17 | C16 | H162 | 109.2° | 109.5° |
| C16 | C17 | O18 | 108.1° | 109.4° |
| C16 | C17 | C19 | 110.8° | 109.4° |
| C16 | C17 | H17 | 109.3° | 109.4° |
| H161 | C16 | H162 | 110.0° | 109.4° |
| O18 | C17 | C19 | 108.8° | 109.5° |
| O18 | C17 | H17 | 111.3° | 109.5° |
| C17 | O18 | H18 | 109.5° | 106.8° |
| C19 | C17 | H17 | 108.6° | 109.5° |
| C17 | C19 | C20 | 111.6° | 109.5° |
| C17 | C19 | N27 | 109.3° | 109.4° |
| C17 | C19 | H19 | 107.7° | 109.5° |
| C20 | C19 | N27 | 107.8° | 109.5° |
| C20 | C19 | H19 | 109.1° | 109.5° |
| C19 | C20 | C21 | 113.3° | 109.5° |
| C19 | C20 | H201 | 107.3° | 109.5° |
| C19 | C20 | H202 | 108.2° | 109.5° |
| N27 | C19 | H19 | 111.4° | 109.5° |
| C19 | N27 | C28 | 112.7° | 106.7° |
| C19 | N27 | H27 | 108.4° | 106.7° |
| C21 | C20 | H201 | 107.4° | 109.4° |
| C21 | C20 | H202 | 108.2° | 109.5° |
| C20 | C21 | C22 | 119.5° | 120.1° |
| C20 | C21 | C26 | 121.1° | 120.0° |
| H201 | C20 | H202 | 112.5° | 109.5° |
| C22 | C21 | C26 | 119.4° | 120.0° |
| C21 | C22 | C23 | 120.4° | 120.0° |
| C21 | C22 | H22 | 119.8° | 120.0° |
| C21 | C26 | C25 | 119.9° | 120.0° |
| C21 | C26 | H26 | 120.0° | 120.0° |
| C23 | C22 | H22 | 119.8° | 120.0° |
| C22 | C23 | C24 | 120.2° | 120.0° |
| C22 | C23 | H23 | 120.0° | 120.0° |
| C24 | C23 | H23 | 119.9° | 120.0° |
| C23 | C24 | C25 | 119.7° | 120.0° |
| C23 | C24 | H24 | 120.2° | 120.0° |
| C25 | C24 | H24 | 120.1° | 120.0° |
| C24 | C25 | C26 | 120.4° | 120.0° |
| C24 | C25 | H25 | 119.8° | 120.0° |
| C26 | C25 | H25 | 119.8° | 120.0° |
| C25 | C26 | H26 | 120.0° | 120.0° |
| C28 | N27 | H27 | 108.4° | 106.7° |
| N27 | C28 | C29 | 104.6° | 109.5° |
| N27 | C28 | H281 | 112.2° | 109.5° |
| N27 | C28 | H282 | 111.1° | 109.5° |
| C29 | C28 | H281 | 112.2° | 109.4° |
| C29 | C28 | H282 | 111.2° | 109.5° |
| C28 | C29 | C30 | 118.8° | 120.0° |
| C28 | C29 | C35 | 120.5° | 120.0° |
| H281 | C28 | H282 | 105.8° | 109.5° |
| C30 | C29 | C35 | 120.6° | 120.0° |
| C29 | C30 | C31 | 120.5° | 120.0° |
| C29 | C30 | H30 | 119.8° | 120.0° |
| C29 | C35 | C33 | 119.6° | 120.0° |
| C29 | C35 | H35 | 120.2° | 120.0° |
| C31 | C30 | H30 | 119.8° | 120.0° |
| C30 | C31 | C32 | 118.8° | 120.0° |
| C30 | C31 | H31 | 120.6° | 120.0° |
| C32 | C31 | H31 | 120.6° | 120.0° |
| C31 | C32 | C33 | 121.2° | 120.0° |
| C31 | C32 | H32 | 119.4° | 120.0° |
| C33 | C32 | H32 | 119.4° | 120.0° |
| C32 | C33 | CL34 | 120.0° | 120.0° |
| C32 | C33 | C35 | 119.4° | 119.9° |
| CL34 | C33 | C35 | 120.6° | 120.1° |
| C33 | C35 | H35 | 120.2° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C1 | H1C1 | H1C2 | 120.0° | 120.0° |
| O2 | C1 | H1C1 | H1C3 | 120.0° | 120.0° |
| O2 | C1 | H1C2 | H1C3 | 120.0° | 120.0° |
| C1 | O2 | C3 | C4 | 3.3° | 0.0° |
| C1 | O2 | C3 | C10 | 174.9° | 179.7° |
| H1C1 | C1 | H1C2 | H1C3 | 120.0° | 120.0° |
| H1C1 | C1 | O2 | C3 | 89.3° | 60.0° |
| H1C2 | C1 | O2 | C3 | 150.7° | 180.0° |
| H1C3 | C1 | O2 | C3 | 30.7° | 60.0° |
| O2 | C3 | C4 | C10 | 178.2° | 179.7° |
| O2 | C3 | C4 | C5 | 179.5° | 180.0° |
| O2 | C3 | C4 | H4 | 0.5° | 0.1° |
| O2 | C3 | C10 | C8 | 178.4° | 179.7° |
| O2 | C3 | C10 | C11 | 0.5° | 0.3° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 179.5° | 180.0° |
| C3 | C4 | C5 | C7 | 1.8° | 0.1° |
| C4 | C3 | C10 | C8 | 0.2° | 0.6° |
| C4 | C3 | C10 | C11 | 178.7° | 180.0° |
| C10 | C3 | C4 | C5 | 1.3° | 0.3° |
| C10 | C3 | C4 | H4 | 178.7° | 179.8° |
| C3 | C10 | C8 | C7 | 0.4° | 0.6° |
| C3 | C10 | C8 | C9 | 179.4° | 179.7° |
| C3 | C10 | C8 | C11 | 178.9° | 179.4° |
| C3 | C10 | C11 | H111 | 51.5° | 90.6° |
| C3 | C10 | C11 | H112 | 171.5° | 29.4° |
| C3 | C10 | C11 | H113 | 68.5° | 149.4° |
| C4 | C5 | C6 | C7 | 178.6° | 179.9° |
| C4 | C5 | C6 | H6C1 | 8.9° | 97.2° |
| C4 | C5 | C6 | H6C2 | 128.9° | 142.7° |
| C4 | C5 | C6 | H6C3 | 111.1° | 22.7° |
| C4 | C5 | C7 | C8 | 1.1° | 0.1° |
| C4 | C5 | C7 | S12 | 179.0° | 180.0° |
| H4 | C4 | C5 | C6 | 0.4° | 0.1° |
| H4 | C4 | C5 | C7 | 178.2° | 180.0° |
| C5 | C6 | H6C1 | H6C2 | 120.0° | 120.1° |
| C5 | C6 | H6C1 | H6C3 | 120.0° | 119.9° |
| C5 | C6 | H6C2 | H6C3 | 120.0° | 119.9° |
| C6 | C5 | C7 | C8 | 179.7° | 180.0° |
| C6 | C5 | C7 | S12 | 0.4° | 0.0° |
| C7 | C5 | C6 | H6C1 | 172.5° | 82.7° |
| C7 | C5 | C6 | H6C2 | 52.5° | 37.4° |
| C7 | C5 | C6 | H6C3 | 67.5° | 157.3° |
| C5 | C7 | C8 | S12 | 179.9° | 180.0° |
| C5 | C7 | C8 | C9 | 179.8° | 180.0° |
| C5 | C7 | C8 | C10 | 0.0° | 0.4° |
| C5 | C7 | S12 | O13 | 3.3° | 155.8° |
| C5 | C7 | S12 | O14 | 131.3° | 21.0° |
| C5 | C7 | S12 | N15 | 115.2° | 91.7° |
| H6C1 | C6 | H6C2 | H6C3 | 120.0° | 120.0° |
| C7 | C8 | C9 | C10 | 179.8° | 179.6° |
| C7 | C8 | C9 | H9C1 | 30.0° | 83.9° |
| C7 | C8 | C9 | H9C2 | 90.0° | 156.2° |
| C7 | C8 | C9 | H9C3 | 149.9° | 36.2° |
| C7 | C8 | C10 | C11 | 179.3° | 180.0° |
| C8 | C7 | S12 | O13 | 176.6° | 24.3° |
| C8 | C7 | S12 | O14 | 48.8° | 159.1° |
| C8 | C7 | S12 | N15 | 64.7° | 88.3° |
| S12 | C7 | C8 | C9 | 0.2° | 0.0° |
| S12 | C7 | C8 | C10 | 179.9° | 179.7° |
| C7 | S12 | O13 | O14 | 125.4° | 123.2° |
| C7 | S12 | O13 | N15 | 114.6° | 113.7° |
| C7 | S12 | O14 | N15 | 115.4° | 113.7° |
| C7 | S12 | N15 | C16 | 48.6° | 65.0° |
| C7 | S12 | N15 | H15 | 168.6° | 115.0° |
| C8 | C9 | H9C1 | H9C2 | 120.0° | 120.0° |
| C8 | C9 | H9C1 | H9C3 | 120.0° | 120.1° |
| C8 | C9 | H9C2 | H9C3 | 120.1° | 120.0° |
| C9 | C8 | C10 | C11 | 0.5° | 0.4° |
| C10 | C8 | C9 | H9C1 | 149.8° | 95.8° |
| C10 | C8 | C9 | H9C2 | 90.2° | 24.2° |
| C10 | C8 | C9 | H9C3 | 29.9° | 144.2° |
| C8 | C10 | C11 | H111 | 127.4° | 90.1° |
| C8 | C10 | C11 | H112 | 7.4° | 150.0° |
| C8 | C10 | C11 | H113 | 112.6° | 30.0° |
| H9C1 | C9 | H9C2 | H9C3 | 119.9° | 119.9° |
| C10 | C11 | H111 | H112 | 120.0° | 120.0° |
| C10 | C11 | H111 | H113 | 120.0° | 120.1° |
| C10 | C11 | H112 | H113 | 120.0° | 120.0° |
| H111 | C11 | H112 | H113 | 120.0° | 119.9° |
| O13 | S12 | O14 | N15 | 119.4° | 123.1° |
| O13 | S12 | N15 | C16 | 65.1° | 177.6° |
| O13 | S12 | N15 | H15 | 54.9° | 2.4° |
| O14 | S12 | N15 | C16 | 163.4° | 47.6° |
| O14 | S12 | N15 | H15 | 76.6° | 132.4° |
| S12 | N15 | C16 | H15 | 120.0° | 180.0° |
| S12 | N15 | C16 | C17 | 106.1° | 165.0° |
| S12 | N15 | C16 | H161 | 13.6° | 75.0° |
| S12 | N15 | C16 | H162 | 133.9° | 44.9° |
| N15 | C16 | C17 | H161 | 119.7° | 120.0° |
| N15 | C16 | C17 | H162 | 120.0° | 120.0° |
| N15 | C16 | H161 | H162 | 119.8° | 120.0° |
| N15 | C16 | C17 | O18 | 33.7° | 65.0° |
| N15 | C16 | C17 | C19 | 152.9° | 175.0° |
| N15 | C16 | C17 | H17 | 87.5° | 55.0° |
| H15 | N15 | C16 | C17 | 13.9° | 15.0° |
| H15 | N15 | C16 | H161 | 133.6° | 105.0° |
| H15 | N15 | C16 | H162 | 106.1° | 135.1° |
| C17 | C16 | H161 | H162 | 119.8° | 120.0° |
| C16 | C17 | O18 | C19 | 120.5° | 120.0° |
| C16 | C17 | O18 | H17 | 120.0° | 120.0° |
| C16 | C17 | C19 | H17 | 120.0° | 119.9° |
| C16 | C17 | O18 | H18 | 13.8° | 60.0° |
| C16 | C17 | C19 | C20 | 49.9° | 65.0° |
| C16 | C17 | C19 | N27 | 69.3° | 175.0° |
| C16 | C17 | C19 | H19 | 169.6° | 55.0° |
| H161 | C16 | C17 | O18 | 153.4° | 55.0° |
| H161 | C16 | C17 | C19 | 87.4° | 65.0° |
| H161 | C16 | C17 | H17 | 32.2° | 175.0° |
| H162 | C16 | C17 | O18 | 86.3° | 174.9° |
| H162 | C16 | C17 | C19 | 32.9° | 54.9° |
| H162 | C16 | C17 | H17 | 152.5° | 65.0° |
| O18 | C17 | C19 | H17 | 121.2° | 120.1° |
| O18 | C17 | C19 | C20 | 168.7° | 54.9° |
| O18 | C17 | C19 | N27 | 49.5° | 65.0° |
| O18 | C17 | C19 | H19 | 71.6° | 175.0° |
| C19 | C17 | O18 | H18 | 106.6° | 59.9° |
| C17 | C19 | C20 | N27 | 120.1° | 120.0° |
| C17 | C19 | C20 | H19 | 118.8° | 120.0° |
| C17 | C19 | N27 | H19 | 118.9° | 120.0° |
| C17 | C19 | C20 | C21 | 51.2° | 177.0° |
| C17 | C19 | C20 | H201 | 67.1° | 63.0° |
| C17 | C19 | C20 | H202 | 171.2° | 57.0° |
| C17 | C19 | N27 | C28 | 149.9° | 86.9° |
| C17 | C19 | N27 | H27 | 29.9° | 26.9° |
| H17 | C17 | O18 | H18 | 133.8° | 180.0° |
| H17 | C17 | C19 | C20 | 70.1° | 175.0° |
| H17 | C17 | C19 | N27 | 170.7° | 55.1° |
| H17 | C17 | C19 | H19 | 49.6° | 65.0° |
| C20 | C19 | N27 | H19 | 119.7° | 120.0° |
| C19 | C20 | C21 | H201 | 118.3° | 120.0° |
| C19 | C20 | C21 | H202 | 120.0° | 120.0° |
| C19 | C20 | H201 | H202 | 118.9° | 120.0° |
| C19 | C20 | C21 | C22 | 130.9° | 95.5° |
| C19 | C20 | C21 | C26 | 50.3° | 84.8° |
| C20 | C19 | N27 | C28 | 88.6° | 153.1° |
| C20 | C19 | N27 | H27 | 151.3° | 93.1° |
| N27 | C19 | C20 | C21 | 171.2° | 63.0° |
| N27 | C19 | C20 | H201 | 52.9° | 56.9° |
| N27 | C19 | C20 | H202 | 68.8° | 176.9° |
| C19 | N27 | C28 | H27 | 120.0° | 113.8° |
| C19 | N27 | C28 | C29 | 178.4° | 174.4° |
| C19 | N27 | C28 | H281 | 59.8° | 54.5° |
| C19 | N27 | C28 | H282 | 58.4° | 65.5° |
| H19 | C19 | C20 | C21 | 67.6° | 57.0° |
| H19 | C19 | C20 | H201 | 174.0° | 177.0° |
| H19 | C19 | C20 | H202 | 52.4° | 63.0° |
| H19 | C19 | N27 | C28 | 31.0° | 33.1° |
| H19 | C19 | N27 | H27 | 89.0° | 146.9° |
| C21 | C20 | H201 | H202 | 119.0° | 120.0° |
| C20 | C21 | C22 | C26 | 178.9° | 179.7° |
| C20 | C21 | C22 | C23 | 179.8° | 180.0° |
| C20 | C21 | C22 | H22 | 0.2° | 0.0° |
| C20 | C21 | C26 | C25 | 179.2° | 179.8° |
| C20 | C21 | C26 | H26 | 0.8° | 0.3° |
| H201 | C20 | C21 | C22 | 12.5° | 24.5° |
| H201 | C20 | C21 | C26 | 168.6° | 155.2° |
| H202 | C20 | C21 | C22 | 109.1° | 144.5° |
| H202 | C20 | C21 | C26 | 69.7° | 35.2° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 1.0° | 0.0° |
| C21 | C22 | C23 | H23 | 179.0° | 180.0° |
| C22 | C21 | C26 | C25 | 0.3° | 0.5° |
| C22 | C21 | C26 | H26 | 179.6° | 180.0° |
| C26 | C21 | C22 | C23 | 0.9° | 0.3° |
| C26 | C21 | C22 | H22 | 179.1° | 179.7° |
| C21 | C26 | C25 | C24 | 0.2° | 0.5° |
| C21 | C26 | C25 | H26 | 180.0° | 179.5° |
| C21 | C26 | C25 | H25 | 179.8° | 179.7° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.5° | 0.0° |
| C22 | C23 | C24 | H24 | 179.5° | 180.0° |
| H22 | C22 | C23 | C24 | 179.0° | 180.0° |
| H22 | C22 | C23 | H23 | 1.0° | 0.0° |
| C23 | C24 | C25 | H24 | 180.0° | 180.0° |
| C23 | C24 | C25 | C26 | 0.1° | 0.2° |
| C23 | C24 | C25 | H25 | 179.9° | 180.0° |
| H23 | C23 | C24 | C25 | 179.5° | 180.0° |
| H23 | C23 | C24 | H24 | 0.5° | 0.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | H26 | 179.9° | 179.9° |
| H24 | C24 | C25 | C26 | 179.9° | 179.8° |
| H24 | C24 | C25 | H25 | 0.1° | 0.0° |
| H25 | C25 | C26 | H26 | 0.2° | 0.2° |
| N27 | C28 | C29 | H281 | 121.8° | 120.0° |
| N27 | C28 | C29 | H282 | 120.0° | 120.0° |
| N27 | C28 | H281 | H282 | 121.3° | 120.0° |
| N27 | C28 | C29 | C30 | 80.1° | 90.0° |
| N27 | C28 | C29 | C35 | 96.5° | 90.3° |
| H27 | N27 | C28 | C29 | 61.6° | 71.8° |
| H27 | N27 | C28 | H281 | 60.2° | 168.3° |
| H27 | N27 | C28 | H282 | 178.4° | 48.3° |
| C29 | C28 | H281 | H282 | 121.3° | 120.0° |
| C28 | C29 | C30 | C35 | 176.6° | 179.8° |
| C28 | C29 | C30 | C31 | 177.5° | 180.0° |
| C28 | C29 | C30 | H30 | 2.5° | 0.0° |
| C28 | C29 | C35 | C33 | 176.7° | 179.8° |
| C28 | C29 | C35 | H35 | 3.3° | 0.2° |
| H281 | C28 | C29 | C30 | 41.7° | 30.0° |
| H281 | C28 | C29 | C35 | 141.6° | 149.8° |
| H282 | C28 | C29 | C30 | 159.9° | 150.0° |
| H282 | C28 | C29 | C35 | 23.5° | 29.8° |
| C29 | C30 | C31 | H30 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.9° | 0.0° |
| C29 | C30 | C31 | H31 | 179.1° | 180.0° |
| C30 | C29 | C35 | C33 | 0.2° | 0.5° |
| C30 | C29 | C35 | H35 | 179.8° | 180.0° |
| C35 | C29 | C30 | C31 | 0.9° | 0.2° |
| C35 | C29 | C30 | H30 | 179.1° | 179.8° |
| C29 | C35 | C33 | C32 | 0.5° | 0.5° |
| C29 | C35 | C33 | CL34 | 179.0° | 179.8° |
| C29 | C35 | C33 | H35 | 180.0° | 179.6° |
| C30 | C31 | C32 | H31 | 180.0° | 180.0° |
| C30 | C31 | C32 | C33 | 0.2° | 0.0° |
| C30 | C31 | C32 | H32 | 179.7° | 179.9° |
| H30 | C30 | C31 | C32 | 179.1° | 180.0° |
| H30 | C30 | C31 | H31 | 0.9° | 0.0° |
| C31 | C32 | C33 | H32 | 180.0° | 179.9° |
| C31 | C32 | C33 | CL34 | 179.0° | 180.0° |
| C31 | C32 | C33 | C35 | 0.5° | 0.3° |
| H31 | C31 | C32 | C33 | 179.8° | 180.0° |
| H31 | C31 | C32 | H32 | 0.2° | 0.1° |
| C32 | C33 | CL34 | C35 | 178.5° | 179.7° |
| C32 | C33 | C35 | H35 | 179.5° | 180.0° |
| H32 | C32 | C33 | CL34 | 1.0° | 0.1° |
| H32 | C32 | C33 | C35 | 179.6° | 179.9° |
| CL34 | C33 | C35 | H35 | 1.0° | 0.2° |
