8PW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O26 | C5 | doub | 1.21Å | 1.23Å | |
| C5 | C8 | sing | 1.51Å | 1.52Å | |
| C5 | N2 | sing | 1.35Å | 1.26Å | |
| C8 | C16 | sing | 1.53Å | 1.53Å | |
| C8 | C17 | sing | 1.53Å | 1.54Å | |
| C8 | C38 | sing | 1.53Å | 1.52Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| N2 | C7 | sing | 1.47Å | 1.49Å | |
| N2 | C10 | sing | 1.47Å | 1.46Å | |
| C7 | C12 | sing | 1.51Å | 1.51Å | |
| C7 | C11 | sing | 1.54Å | 1.51Å | |
| C12 | N14 | sing | 1.35Å | 1.32Å | |
| C12 | O27 | doub | 1.21Å | 1.21Å | |
| N14 | C13 | sing | 1.47Å | 1.45Å | |
| C13 | C18 | sing | 1.51Å | 1.51Å | |
| C18 | HXT | sing | 1.08Å | 1.08Å | |
| C13 | C23 | sing | 1.53Å | 1.52Å | |
| C13 | C24 | sing | 1.53Å | 1.53Å | |
| C18 | N19 | doub | 1.28Å | 1.25Å | |
| N19 | H19 | sing | 0.97Å | 1.00Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C11 | C3 | sing | 1.55Å | 1.52Å | |
| C10 | C3 | sing | 1.55Å | 1.52Å | |
| C3 | S1 | sing | 1.81Å | 1.69Å | |
| S1 | O20 | doub | 1.42Å | 1.40Å | |
| S1 | O21 | doub | 1.42Å | 1.42Å | |
| S1 | C6 | sing | 1.76Å | 1.66Å | |
| C6 | C4 | sing | 1.38Å | 1.51Å | Aromatic |
| C6 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C9 | sing | 1.51Å | 1.52Å | |
| C4 | C25 | doub | 1.38Å | 1.43Å | Aromatic |
| C9 | F28 | sing | 1.40Å | 1.31Å | |
| C9 | F29 | sing | 1.40Å | 1.34Å | |
| C9 | F30 | sing | 1.40Å | 1.32Å | |
| C25 | C35 | sing | 1.39Å | 1.41Å | Aromatic |
| C22 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | C35 | doub | 1.39Å | 1.39Å | Aromatic |
| C35 | O36 | sing | 1.36Å | 1.39Å | |
| O36 | C31 | sing | 1.43Å | 1.44Å | |
| C31 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | F34 | sing | 1.40Å | 1.32Å | |
| C15 | F32 | sing | 1.40Å | 1.33Å | |
| C15 | F33 | sing | 1.40Å | 1.33Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C38 | H383 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| N14 | H14 | sing | 0.97Å | 1.00Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O26 | C5 | C8 | 120.5° | 120.0° |
| O26 | C5 | N2 | 123.4° | 120.0° |
| C8 | C5 | N2 | 116.1° | 120.0° |
| C5 | C8 | C16 | 118.9° | 117.5° |
| C5 | C8 | C17 | 110.4° | 117.5° |
| C5 | C8 | C38 | 115.7° | 115.6° |
| C5 | N2 | C7 | 119.4° | 125.6° |
| C5 | N2 | C10 | 130.5° | 125.6° |
| C16 | C8 | C17 | 59.1° | 60.0° |
| C16 | C8 | C38 | 122.0° | 117.5° |
| C8 | C16 | C17 | 60.7° | 60.0° |
| C8 | C16 | H161 | 119.9° | 117.6° |
| C8 | C16 | H162 | 119.9° | 117.5° |
| C17 | C8 | C38 | 116.7° | 117.5° |
| C8 | C17 | C16 | 60.2° | 60.0° |
| C8 | C17 | H171 | 120.0° | 117.5° |
| C8 | C17 | H172 | 120.0° | 117.5° |
| C8 | C38 | H381 | 109.5° | 109.4° |
| C8 | C38 | H382 | 109.5° | 109.5° |
| C8 | C38 | H383 | 109.5° | 109.5° |
| C17 | C16 | H161 | 119.9° | 117.5° |
| C17 | C16 | H162 | 119.9° | 117.5° |
| C16 | C17 | H171 | 120.0° | 117.5° |
| C16 | C17 | H172 | 120.0° | 117.5° |
| C7 | N2 | C10 | 110.0° | 108.7° |
| N2 | C7 | C12 | 115.3° | 109.9° |
| N2 | C7 | C11 | 105.0° | 107.3° |
| N2 | C7 | H7 | 108.1° | 109.9° |
| N2 | C10 | C3 | 106.8° | 104.7° |
| N2 | C10 | H101 | 110.1° | 110.3° |
| N2 | C10 | H102 | 110.1° | 110.4° |
| C12 | C7 | C11 | 112.6° | 109.8° |
| C7 | C12 | N14 | 112.7° | 120.0° |
| C7 | C12 | O27 | 123.3° | 120.0° |
| C12 | C7 | H7 | 107.8° | 109.9° |
| C7 | C11 | C3 | 105.5° | 102.9° |
| C11 | C7 | H7 | 107.8° | 110.0° |
| C7 | C11 | H111 | 110.5° | 110.8° |
| C7 | C11 | H112 | 110.5° | 110.7° |
| N14 | C12 | O27 | 123.9° | 120.0° |
| C12 | N14 | C13 | 122.4° | 120.0° |
| C12 | N14 | H14 | 118.8° | 120.0° |
| N14 | C13 | C18 | 121.3° | 115.5° |
| N14 | C13 | C23 | 114.8° | 117.5° |
| N14 | C13 | C24 | 114.5° | 117.5° |
| C13 | N14 | H14 | 118.8° | 120.0° |
| C13 | C18 | HXT | 122.3° | 119.9° |
| C18 | C13 | C23 | 117.5° | 117.5° |
| C18 | C13 | C24 | 113.1° | 117.6° |
| C13 | C18 | N19 | 115.5° | 120.1° |
| HXT | C18 | N19 | 122.2° | 120.0° |
| C23 | C13 | C24 | 60.7° | 60.0° |
| C13 | C23 | C24 | 59.9° | 60.0° |
| C13 | C23 | H231 | 120.0° | 117.5° |
| C13 | C23 | H232 | 120.0° | 117.6° |
| C13 | C24 | C23 | 59.4° | 60.0° |
| C13 | C24 | H241 | 120.1° | 117.5° |
| C13 | C24 | H242 | 120.1° | 117.5° |
| C18 | N19 | H19 | 112.0° | 120.0° |
| C24 | C23 | H231 | 120.0° | 117.5° |
| C24 | C23 | H232 | 120.0° | 117.5° |
| C23 | C24 | H241 | 120.1° | 117.5° |
| C23 | C24 | H242 | 120.1° | 117.5° |
| C11 | C3 | C10 | 103.9° | 101.5° |
| C11 | C3 | S1 | 109.1° | 111.0° |
| C3 | C11 | H111 | 110.4° | 110.7° |
| C3 | C11 | H112 | 110.5° | 110.7° |
| C11 | C3 | H3 | 110.2° | 111.0° |
| C10 | C3 | S1 | 115.1° | 110.9° |
| C3 | C10 | H101 | 110.1° | 110.5° |
| C3 | C10 | H102 | 110.2° | 110.4° |
| C10 | C3 | H3 | 110.3° | 111.1° |
| C3 | S1 | O20 | 110.6° | 110.5° |
| C3 | S1 | O21 | 110.7° | 110.5° |
| C3 | S1 | C6 | 108.1° | 104.5° |
| S1 | C3 | H3 | 108.2° | 110.9° |
| O20 | S1 | O21 | 113.2° | 121.0° |
| O20 | S1 | C6 | 105.4° | 104.3° |
| O21 | S1 | C6 | 108.6° | 104.3° |
| S1 | C6 | C4 | 126.1° | 120.0° |
| S1 | C6 | C22 | 116.6° | 119.9° |
| C4 | C6 | C22 | 117.3° | 120.1° |
| C6 | C4 | C9 | 123.8° | 119.9° |
| C6 | C4 | C25 | 118.5° | 120.1° |
| C6 | C22 | C37 | 122.0° | 120.0° |
| C6 | C22 | H22 | 119.0° | 120.0° |
| C9 | C4 | C25 | 117.6° | 119.9° |
| C4 | C9 | F28 | 106.4° | 109.5° |
| C4 | C9 | F29 | 112.8° | 109.5° |
| C4 | C9 | F30 | 112.4° | 109.5° |
| C4 | C25 | C35 | 120.3° | 119.9° |
| C4 | C25 | H25 | 119.9° | 120.1° |
| F28 | C9 | F29 | 109.0° | 109.5° |
| F28 | C9 | F30 | 109.7° | 109.5° |
| F29 | C9 | F30 | 106.5° | 109.5° |
| C25 | C35 | C37 | 120.0° | 119.9° |
| C25 | C35 | O36 | 120.9° | 120.0° |
| C35 | C25 | H25 | 119.8° | 120.0° |
| C22 | C37 | C35 | 121.9° | 119.9° |
| C37 | C22 | H22 | 119.0° | 120.0° |
| C22 | C37 | H37 | 119.0° | 120.0° |
| C37 | C35 | O36 | 119.2° | 120.1° |
| C35 | C37 | H37 | 119.1° | 120.0° |
| C35 | O36 | C31 | 119.8° | 117.0° |
| O36 | C31 | C15 | 112.7° | 109.5° |
| O36 | C31 | H311 | 108.6° | 109.4° |
| O36 | C31 | H312 | 108.7° | 109.5° |
| C31 | C15 | F34 | 110.7° | 109.5° |
| C31 | C15 | F32 | 107.2° | 109.5° |
| C31 | C15 | F33 | 108.5° | 109.4° |
| C15 | C31 | H311 | 108.7° | 109.5° |
| C15 | C31 | H312 | 108.6° | 109.5° |
| F34 | C15 | F32 | 110.0° | 109.5° |
| F34 | C15 | F33 | 109.2° | 109.5° |
| F32 | C15 | F33 | 111.2° | 109.4° |
| H161 | C16 | H162 | 109.4° | 115.6° |
| H171 | C17 | H172 | 109.5° | 115.5° |
| H381 | C38 | H382 | 109.5° | 109.5° |
| H381 | C38 | H383 | 109.4° | 109.4° |
| H382 | C38 | H383 | 109.5° | 109.5° |
| H101 | C10 | H102 | 109.5° | 110.5° |
| H111 | C11 | H112 | 109.4° | 110.8° |
| H231 | C23 | H232 | 109.5° | 115.5° |
| H241 | C24 | H242 | 109.5° | 115.6° |
| H311 | C31 | H312 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O26 | C5 | C8 | N2 | 178.5° | 179.7° |
| O26 | C5 | C8 | C16 | 107.8° | 10.6° |
| O26 | C5 | C8 | C17 | 42.7° | 79.3° |
| O26 | C5 | C8 | C38 | 92.5° | 135.1° |
| O26 | C5 | N2 | C7 | 1.3° | 4.1° |
| O26 | C5 | N2 | C10 | 176.8° | 176.2° |
| C5 | C8 | C16 | C17 | 97.6° | 107.5° |
| C5 | C8 | C16 | C38 | 158.3° | 145.0° |
| C5 | C8 | C17 | C38 | 134.8° | 145.0° |
| C8 | C5 | N2 | C7 | 177.2° | 176.2° |
| C8 | C5 | N2 | C10 | 1.7° | 3.5° |
| C5 | C8 | C16 | H161 | 152.7° | 145.0° |
| C5 | C8 | C16 | H162 | 12.0° | 0.0° |
| C5 | C8 | C17 | H171 | 2.7° | 0.0° |
| C5 | C8 | C17 | H172 | 138.3° | 145.0° |
| C5 | C8 | C38 | H381 | 180.0° | 52.6° |
| C5 | C8 | C38 | H382 | 60.0° | 172.6° |
| C5 | C8 | C38 | H383 | 60.0° | 67.3° |
| N2 | C5 | C8 | C16 | 70.7° | 169.1° |
| N2 | C5 | C8 | C17 | 135.8° | 100.5° |
| N2 | C5 | C8 | C38 | 88.9° | 45.2° |
| C5 | N2 | C7 | C10 | 176.4° | 179.8° |
| C5 | N2 | C7 | C12 | 46.9° | 59.6° |
| C5 | N2 | C7 | C11 | 171.4° | 178.9° |
| C5 | N2 | C10 | C3 | 169.2° | 155.8° |
| C5 | N2 | C7 | H7 | 73.7° | 61.5° |
| C5 | N2 | C10 | H101 | 49.6° | 85.3° |
| C5 | N2 | C10 | H102 | 71.2° | 37.1° |
| C16 | C8 | C17 | C38 | 113.0° | 107.5° |
| C8 | C16 | C17 | H161 | 109.7° | 107.5° |
| C8 | C16 | C17 | H162 | 109.7° | 107.5° |
| C8 | C16 | H161 | H162 | 144.4° | 145.7° |
| C16 | C8 | C17 | H171 | 109.5° | 107.5° |
| C16 | C8 | C17 | H172 | 109.5° | 107.5° |
| C16 | C8 | C38 | H381 | 21.0° | 93.1° |
| C16 | C8 | C38 | H382 | 141.1° | 26.9° |
| C16 | C8 | C38 | H383 | 98.9° | 147.0° |
| C8 | C17 | H171 | H172 | 144.6° | 145.7° |
| C17 | C8 | C38 | H381 | 47.6° | 161.7° |
| C17 | C8 | C38 | H382 | 72.4° | 41.8° |
| C17 | C8 | C38 | H383 | 167.6° | 78.4° |
| C38 | C8 | C16 | H161 | 5.6° | 0.0° |
| C38 | C8 | C16 | H162 | 146.2° | 145.1° |
| C38 | C8 | C17 | H171 | 137.5° | 145.0° |
| C38 | C8 | C17 | H172 | 3.5° | 0.0° |
| C8 | C38 | H381 | H382 | 120.0° | 120.0° |
| C8 | C38 | H381 | H383 | 120.0° | 119.9° |
| C8 | C38 | H382 | H383 | 120.0° | 120.1° |
| C17 | C16 | H161 | H162 | 144.3° | 145.6° |
| C16 | C17 | H171 | H172 | 144.6° | 145.7° |
| N2 | C7 | C12 | C11 | 120.4° | 117.8° |
| N2 | C7 | C12 | H7 | 120.8° | 121.1° |
| N2 | C7 | C11 | H7 | 115.1° | 119.5° |
| N2 | C7 | C12 | N14 | 128.0° | 180.0° |
| N2 | C7 | C12 | O27 | 50.7° | 0.0° |
| N2 | C7 | C11 | C3 | 26.1° | 22.2° |
| C7 | N2 | C10 | C3 | 6.6° | 24.4° |
| C7 | N2 | C10 | H101 | 126.2° | 94.4° |
| C7 | N2 | C10 | H102 | 113.0° | 143.2° |
| N2 | C7 | C11 | H111 | 93.2° | 140.6° |
| N2 | C7 | C11 | H112 | 145.5° | 96.2° |
| C10 | N2 | C7 | C12 | 136.7° | 120.7° |
| C10 | N2 | C7 | C11 | 12.2° | 1.3° |
| N2 | C10 | C3 | C11 | 22.5° | 37.2° |
| N2 | C10 | C3 | H101 | 119.6° | 118.8° |
| N2 | C10 | C3 | H102 | 119.6° | 118.8° |
| N2 | C10 | C3 | S1 | 96.8° | 155.3° |
| C10 | N2 | C7 | H7 | 102.6° | 118.3° |
| N2 | C10 | H101 | H102 | 121.2° | 122.3° |
| N2 | C10 | C3 | H3 | 140.5° | 80.8° |
| C12 | C7 | C11 | H7 | 118.8° | 121.0° |
| C7 | C12 | N14 | O27 | 178.7° | 180.0° |
| C7 | C12 | N14 | C13 | 177.8° | 180.0° |
| C12 | C7 | C11 | C3 | 152.3° | 97.3° |
| C12 | C7 | C11 | H111 | 32.9° | 21.1° |
| C12 | C7 | C11 | H112 | 88.3° | 144.4° |
| C7 | C12 | N14 | H14 | 2.2° | 0.0° |
| C11 | C7 | C12 | N14 | 111.6° | 62.2° |
| C11 | C7 | C12 | O27 | 69.7° | 117.8° |
| C7 | C11 | C3 | H111 | 119.4° | 118.4° |
| C7 | C11 | C3 | H112 | 119.4° | 118.3° |
| C7 | C11 | C3 | C10 | 29.9° | 35.6° |
| C7 | C11 | C3 | S1 | 93.3° | 153.5° |
| C7 | C11 | H111 | H112 | 121.8° | 123.2° |
| C7 | C11 | C3 | H3 | 148.0° | 82.6° |
| C12 | N14 | C13 | H14 | 180.0° | 179.9° |
| C12 | N14 | C13 | C18 | 85.1° | 34.4° |
| C12 | N14 | C13 | C23 | 66.1° | 179.9° |
| C12 | N14 | C13 | C24 | 133.6° | 111.3° |
| N14 | C12 | C7 | H7 | 7.1° | 59.0° |
| O27 | C12 | N14 | C13 | 0.9° | 0.0° |
| O27 | C12 | C7 | H7 | 171.5° | 121.0° |
| O27 | C12 | N14 | H14 | 179.1° | 180.0° |
| N14 | C13 | C18 | C23 | 150.4° | 145.6° |
| N14 | C13 | C18 | C24 | 141.8° | 145.7° |
| N14 | C13 | C18 | HXT | 3.1° | 154.4° |
| N14 | C13 | C23 | C24 | 105.3° | 107.5° |
| N14 | C13 | C18 | N19 | 176.9° | 25.5° |
| N14 | C13 | C23 | H231 | 145.3° | 145.0° |
| N14 | C13 | C23 | H232 | 4.2° | 0.0° |
| N14 | C13 | C24 | H241 | 3.5° | 0.0° |
| N14 | C13 | C24 | H242 | 144.8° | 145.0° |
| C13 | C18 | HXT | N19 | 180.0° | 180.0° |
| C18 | C13 | C23 | C24 | 102.4° | 107.6° |
| C13 | C18 | N19 | H19 | 180.0° | 180.0° |
| C18 | C13 | N14 | H14 | 94.9° | 145.5° |
| C18 | C13 | C23 | H231 | 7.0° | 0.1° |
| C18 | C13 | C23 | H232 | 148.2° | 144.9° |
| C18 | C13 | C24 | H241 | 141.1° | 145.0° |
| C18 | C13 | C24 | H242 | 0.3° | 0.0° |
| HXT | C18 | C13 | C23 | 153.5° | 60.0° |
| HXT | C18 | C13 | C24 | 138.8° | 8.7° |
| HXT | C18 | N19 | H19 | 0.0° | 0.0° |
| C23 | C13 | C18 | N19 | 26.5° | 120.1° |
| C13 | C23 | C24 | H231 | 109.5° | 107.5° |
| C13 | C23 | C24 | H232 | 109.5° | 107.5° |
| C23 | C13 | N14 | H14 | 113.9° | 0.1° |
| C13 | C23 | H231 | H232 | 144.8° | 145.7° |
| C23 | C13 | C24 | H241 | 109.3° | 107.5° |
| C23 | C13 | C24 | H242 | 109.3° | 107.5° |
| C24 | C13 | C18 | N19 | 41.2° | 171.2° |
| C24 | C13 | N14 | H14 | 46.4° | 68.8° |
| C13 | C24 | H241 | H242 | 145.0° | 145.6° |
| C24 | C23 | H231 | H232 | 144.8° | 145.7° |
| C23 | C24 | H241 | H242 | 145.1° | 145.8° |
| C11 | C3 | C10 | S1 | 119.3° | 118.0° |
| C11 | C3 | C10 | H3 | 118.1° | 118.1° |
| C11 | C3 | S1 | H3 | 119.9° | 123.9° |
| C11 | C3 | S1 | O20 | 65.7° | 70.9° |
| C11 | C3 | S1 | O21 | 60.6° | 65.8° |
| C11 | C3 | S1 | C6 | 179.4° | 177.4° |
| C3 | C11 | C7 | H7 | 88.9° | 141.7° |
| C11 | C3 | C10 | H101 | 142.1° | 81.5° |
| C11 | C3 | C10 | H102 | 97.1° | 156.0° |
| C3 | C11 | H111 | H112 | 121.8° | 123.2° |
| C10 | C3 | S1 | H3 | 123.8° | 124.0° |
| C10 | C3 | S1 | O20 | 178.1° | 177.0° |
| C10 | C3 | S1 | O21 | 55.7° | 46.3° |
| C10 | C3 | S1 | C6 | 63.1° | 65.4° |
| C3 | C10 | H101 | H102 | 121.3° | 122.4° |
| C10 | C3 | C11 | H111 | 89.5° | 154.0° |
| C10 | C3 | C11 | H112 | 149.3° | 82.7° |
| C3 | S1 | O20 | O21 | 124.9° | 131.5° |
| C3 | S1 | O20 | C6 | 116.6° | 111.8° |
| C3 | S1 | O21 | C6 | 118.6° | 111.8° |
| C3 | S1 | C6 | C4 | 76.7° | 104.3° |
| C3 | S1 | C6 | C22 | 102.7° | 76.0° |
| S1 | C3 | C10 | H101 | 22.8° | 36.5° |
| S1 | C3 | C10 | H102 | 143.6° | 86.0° |
| S1 | C3 | C11 | H111 | 147.3° | 88.1° |
| S1 | C3 | C11 | H112 | 26.1° | 35.2° |
| O20 | S1 | O21 | C6 | 116.6° | 116.8° |
| O20 | S1 | C6 | C4 | 41.6° | 11.7° |
| O20 | S1 | C6 | C22 | 139.0° | 168.0° |
| O20 | S1 | C3 | H3 | 54.3° | 53.0° |
| O21 | S1 | C6 | C4 | 163.2° | 139.6° |
| O21 | S1 | C6 | C22 | 17.5° | 40.1° |
| O21 | S1 | C3 | H3 | 179.5° | 170.3° |
| S1 | C6 | C4 | C22 | 179.4° | 179.7° |
| S1 | C6 | C4 | C9 | 1.3° | 0.0° |
| S1 | C6 | C4 | C25 | 179.7° | 180.0° |
| S1 | C6 | C22 | C37 | 179.1° | 179.9° |
| C6 | S1 | C3 | H3 | 60.7° | 58.7° |
| S1 | C6 | C22 | H22 | 0.9° | 0.0° |
| C6 | C4 | C9 | C25 | 179.0° | 180.0° |
| C6 | C4 | C9 | F28 | 71.8° | 173.9° |
| C6 | C4 | C9 | F29 | 168.8° | 53.9° |
| C6 | C4 | C9 | F30 | 48.3° | 66.1° |
| C6 | C4 | C25 | C35 | 0.7° | 0.0° |
| C4 | C6 | C22 | C37 | 0.4° | 0.2° |
| C4 | C6 | C22 | H22 | 179.7° | 179.8° |
| C6 | C4 | C25 | H25 | 179.3° | 180.0° |
| C22 | C6 | C4 | C9 | 179.3° | 179.8° |
| C22 | C6 | C4 | C25 | 0.3° | 0.3° |
| C6 | C22 | C37 | H22 | 180.0° | 179.9° |
| C6 | C22 | C37 | C35 | 0.7° | 0.1° |
| C6 | C22 | C37 | H37 | 179.3° | 179.9° |
| C4 | C9 | F28 | F29 | 121.9° | 120.1° |
| C4 | C9 | F28 | F30 | 121.8° | 120.0° |
| C4 | C9 | F29 | F30 | 123.8° | 120.0° |
| C9 | C4 | C25 | C35 | 179.7° | 180.0° |
| C9 | C4 | C25 | H25 | 0.3° | 0.0° |
| C25 | C4 | C9 | F28 | 107.2° | 6.1° |
| C25 | C4 | C9 | F29 | 12.2° | 126.1° |
| C25 | C4 | C9 | F30 | 132.7° | 113.9° |
| C4 | C25 | C35 | H25 | 180.0° | 180.0° |
| C4 | C25 | C35 | C37 | 0.4° | 0.2° |
| C4 | C25 | C35 | O36 | 179.5° | 180.0° |
| F28 | C9 | F29 | F30 | 118.2° | 120.0° |
| C25 | C35 | C37 | C22 | 0.3° | 0.3° |
| C25 | C35 | C37 | O36 | 179.9° | 179.7° |
| C25 | C35 | O36 | C31 | 179.0° | 180.0° |
| C25 | C35 | C37 | H37 | 179.7° | 179.7° |
| C22 | C37 | C35 | H37 | 180.0° | 180.0° |
| C22 | C37 | C35 | O36 | 179.8° | 180.0° |
| C37 | C35 | O36 | C31 | 0.9° | 0.3° |
| C35 | C37 | C22 | H22 | 179.3° | 180.0° |
| C37 | C35 | C25 | H25 | 179.6° | 179.7° |
| C35 | O36 | C31 | C15 | 165.7° | 180.0° |
| O36 | C35 | C25 | H25 | 0.5° | 0.0° |
| O36 | C35 | C37 | H37 | 0.2° | 0.0° |
| C35 | O36 | C31 | H311 | 45.2° | 60.0° |
| C35 | O36 | C31 | H312 | 73.9° | 60.0° |
| O36 | C31 | C15 | H311 | 120.5° | 120.0° |
| O36 | C31 | C15 | H312 | 120.5° | 120.0° |
| O36 | C31 | C15 | F34 | 57.4° | 60.0° |
| O36 | C31 | C15 | F32 | 62.6° | 180.0° |
| O36 | C31 | C15 | F33 | 177.3° | 60.1° |
| O36 | C31 | H311 | H312 | 118.5° | 120.0° |
| C31 | C15 | F34 | F32 | 118.4° | 120.0° |
| C31 | C15 | F34 | F33 | 119.4° | 120.0° |
| C31 | C15 | F32 | F33 | 118.5° | 119.9° |
| C15 | C31 | H311 | H312 | 118.5° | 120.0° |
| F34 | C15 | F32 | F33 | 121.1° | 120.0° |
| F34 | C15 | C31 | H311 | 177.9° | 60.0° |
| F34 | C15 | C31 | H312 | 63.1° | 180.0° |
| F32 | C15 | C31 | H311 | 57.9° | 60.1° |
| F32 | C15 | C31 | H312 | 177.0° | 60.0° |
| F33 | C15 | C31 | H311 | 62.2° | 180.0° |
| F33 | C15 | C31 | H312 | 56.8° | 60.0° |
| H161 | C16 | C17 | H171 | 140.8° | 145.0° |
| H161 | C16 | C17 | H172 | 0.2° | 0.0° |
| H162 | C16 | C17 | H171 | 0.2° | 0.0° |
| H162 | C16 | C17 | H172 | 140.8° | 145.0° |
| H381 | C38 | H382 | H383 | 120.0° | 120.0° |
| H7 | C7 | C11 | H111 | 151.7° | 99.9° |
| H7 | C7 | C11 | H112 | 30.5° | 23.4° |
| H101 | C10 | C3 | H3 | 99.9° | 160.4° |
| H102 | C10 | C3 | H3 | 21.0° | 37.9° |
| H111 | C11 | C3 | H3 | 28.6° | 35.8° |
| H112 | C11 | C3 | H3 | 92.6° | 159.1° |
| H231 | C23 | C24 | H241 | 141.2° | 145.1° |
| H231 | C23 | C24 | H242 | 0.2° | 0.1° |
| H232 | C23 | C24 | H241 | 0.1° | 0.1° |
| H232 | C23 | C24 | H242 | 141.3° | 145.0° |
| H22 | C22 | C37 | H37 | 0.7° | 0.0° |
