MKK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C10 | sing | 1.51Å | 1.44Å | |
| C1 | C6 | doub | 1.38Å | 1.44Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.44Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.52Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | C4 | sing | 1.39Å | 1.36Å | Aromatic |
| C3 | N4 | sing | 1.40Å | 1.42Å | |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | F40 | sing | 1.35Å | 1.28Å | |
| C5 | C6 | sing | 1.38Å | 1.45Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| N4 | N1 | sing | 1.28Å | 1.29Å | |
| N4 | C14 | sing | 1.47Å | 1.44Å | |
| N1 | C24 | doub | 1.30Å | 1.32Å | |
| C24 | C13 | sing | 1.52Å | 1.49Å | |
| C24 | C29 | sing | 1.41Å | 1.53Å | |
| C13 | C7 | sing | 1.53Å | 1.57Å | |
| C13 | C14 | sing | 1.54Å | 1.56Å | |
| C13 | C17 | sing | 1.51Å | 1.52Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C17 | C19 | doub | 1.38Å | 1.45Å | Aromatic |
| C17 | C23 | sing | 1.38Å | 1.49Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.46Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | C21 | doub | 1.38Å | 1.51Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | sing | 1.38Å | 1.46Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | C23 | doub | 1.38Å | 1.45Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | C9 | sing | 1.51Å | 1.57Å | |
| C29 | O39 | doub | 1.21Å | 1.27Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | H93 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H103 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.50Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C8 | C11 | sing | 1.53Å | 1.55Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C11 | N2 | sing | 1.47Å | 1.53Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| N2 | C15 | sing | 1.47Å | 1.52Å | |
| N2 | C12 | sing | 1.47Å | 1.53Å | |
| C12 | C18 | sing | 1.53Å | 1.59Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.56Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | N3 | sing | 1.47Å | 1.55Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C18 | N3 | sing | 1.47Å | 1.50Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| N3 | C25 | sing | 1.35Å | 1.48Å | |
| C25 | O1 | doub | 1.21Å | 1.24Å | |
| C25 | C26 | sing | 1.51Å | 1.55Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C1 | C6 | 114.9° | 120.0° |
| C10 | C1 | C2 | 128.0° | 119.9° |
| C1 | C10 | H101 | 109.5° | 109.4° |
| C1 | C10 | H102 | 109.5° | 109.5° |
| C1 | C10 | H103 | 109.5° | 109.4° |
| C6 | C1 | C2 | 117.1° | 120.1° |
| C1 | C6 | C5 | 125.1° | 120.2° |
| C1 | C6 | H6 | 117.4° | 119.9° |
| C1 | C2 | C3 | 118.3° | 119.9° |
| C1 | C2 | H2 | 120.9° | 120.0° |
| C3 | C2 | H2 | 120.8° | 120.0° |
| C2 | C3 | C4 | 117.5° | 119.8° |
| C2 | C3 | N4 | 115.1° | 120.1° |
| C4 | C3 | N4 | 127.4° | 120.1° |
| C3 | C4 | C5 | 128.0° | 119.9° |
| C3 | C4 | F40 | 120.4° | 120.1° |
| C3 | N4 | N1 | 124.9° | 124.8° |
| C3 | N4 | C14 | 131.3° | 124.7° |
| C5 | C4 | F40 | 111.6° | 120.1° |
| C4 | C5 | C6 | 113.8° | 120.0° |
| C4 | C5 | H5 | 123.1° | 120.0° |
| C6 | C5 | H5 | 123.1° | 120.0° |
| C5 | C6 | H6 | 117.4° | 119.9° |
| N1 | N4 | C14 | 103.4° | 110.5° |
| N4 | N1 | C24 | 123.3° | 116.4° |
| N4 | C14 | C13 | 104.8° | 102.9° |
| N4 | C14 | H141 | 111.1° | 110.7° |
| N4 | C14 | H142 | 112.1° | 110.8° |
| N1 | C24 | C13 | 102.2° | 108.2° |
| N1 | C24 | C29 | 123.3° | 125.9° |
| C13 | C24 | C29 | 134.4° | 125.9° |
| C24 | C13 | C7 | 105.5° | 110.9° |
| C24 | C13 | C14 | 102.6° | 102.0° |
| C24 | C13 | C17 | 111.6° | 110.9° |
| C24 | C29 | C9 | 112.8° | 120.0° |
| C24 | C29 | O39 | 126.5° | 120.0° |
| C7 | C13 | C14 | 114.4° | 110.7° |
| C7 | C13 | C17 | 120.1° | 110.8° |
| C13 | C7 | C8 | 112.9° | 109.5° |
| C13 | C7 | H71 | 108.3° | 109.5° |
| C13 | C7 | H72 | 107.5° | 109.5° |
| C14 | C13 | C17 | 101.5° | 111.1° |
| C13 | C14 | H141 | 111.1° | 110.8° |
| C13 | C14 | H142 | 112.1° | 110.6° |
| C13 | C17 | C19 | 118.7° | 120.0° |
| C13 | C17 | C23 | 118.9° | 120.0° |
| H141 | C14 | H142 | 105.9° | 110.8° |
| C19 | C17 | C23 | 122.4° | 120.0° |
| C17 | C19 | C20 | 116.1° | 120.1° |
| C17 | C19 | H19 | 122.0° | 120.0° |
| C17 | C23 | C22 | 125.0° | 120.0° |
| C17 | C23 | H23 | 117.5° | 120.0° |
| C20 | C19 | H19 | 121.9° | 120.0° |
| C19 | C20 | C21 | 118.9° | 120.0° |
| C19 | C20 | H20 | 120.5° | 120.1° |
| C21 | C20 | H20 | 120.6° | 120.0° |
| C20 | C21 | C22 | 126.6° | 120.0° |
| C20 | C21 | H21 | 116.7° | 120.0° |
| C22 | C21 | H21 | 116.7° | 120.0° |
| C21 | C22 | C23 | 110.9° | 120.0° |
| C21 | C22 | H22 | 124.6° | 120.0° |
| C23 | C22 | H22 | 124.6° | 120.0° |
| C22 | C23 | H23 | 117.5° | 120.0° |
| C9 | C29 | O39 | 120.7° | 120.0° |
| C29 | C9 | H91 | 109.5° | 109.5° |
| C29 | C9 | H92 | 109.5° | 109.5° |
| C29 | C9 | H93 | 109.4° | 109.5° |
| H91 | C9 | H92 | 109.5° | 109.4° |
| H91 | C9 | H93 | 109.5° | 109.4° |
| H92 | C9 | H93 | 109.5° | 109.5° |
| H101 | C10 | H102 | 109.4° | 109.5° |
| H101 | C10 | H103 | 109.5° | 109.5° |
| H102 | C10 | H103 | 109.5° | 109.5° |
| C8 | C7 | H71 | 108.4° | 109.5° |
| C8 | C7 | H72 | 107.6° | 109.5° |
| C7 | C8 | C11 | 116.5° | 109.5° |
| C7 | C8 | H81 | 107.2° | 109.5° |
| C7 | C8 | H82 | 105.6° | 109.5° |
| H71 | C7 | H72 | 112.2° | 109.4° |
| C11 | C8 | H81 | 107.2° | 109.4° |
| C11 | C8 | H82 | 105.6° | 109.5° |
| C8 | C11 | N2 | 107.8° | 109.5° |
| C8 | C11 | H111 | 110.0° | 109.5° |
| C8 | C11 | H112 | 110.3° | 109.5° |
| H81 | C8 | H82 | 115.2° | 109.4° |
| N2 | C11 | H111 | 110.0° | 109.5° |
| N2 | C11 | H112 | 110.4° | 109.5° |
| C11 | N2 | C15 | 114.0° | 111.0° |
| C11 | N2 | C12 | 108.0° | 111.0° |
| H111 | C11 | H112 | 108.2° | 109.4° |
| C15 | N2 | C12 | 115.6° | 111.2° |
| N2 | C15 | C16 | 109.3° | 109.3° |
| N2 | C15 | H151 | 109.5° | 109.5° |
| N2 | C15 | H152 | 109.6° | 109.5° |
| N2 | C12 | C18 | 101.1° | 109.3° |
| N2 | C12 | H121 | 112.3° | 109.5° |
| N2 | C12 | H122 | 114.1° | 109.5° |
| C18 | C12 | H121 | 112.4° | 109.5° |
| C18 | C12 | H122 | 114.1° | 109.5° |
| C12 | C18 | N3 | 103.7° | 108.5° |
| C12 | C18 | H181 | 111.4° | 109.6° |
| C12 | C18 | H182 | 112.7° | 109.6° |
| H121 | C12 | H122 | 103.2° | 109.5° |
| C16 | C15 | H151 | 109.5° | 109.5° |
| C16 | C15 | H152 | 109.5° | 109.5° |
| C15 | C16 | N3 | 110.3° | 108.5° |
| C15 | C16 | H161 | 109.2° | 109.6° |
| C15 | C16 | H162 | 109.0° | 109.6° |
| H151 | C15 | H152 | 109.4° | 109.5° |
| N3 | C16 | H161 | 109.2° | 109.6° |
| N3 | C16 | H162 | 109.0° | 109.7° |
| C16 | N3 | C18 | 112.1° | 118.2° |
| C16 | N3 | C25 | 131.0° | 120.9° |
| H161 | C16 | H162 | 110.2° | 109.8° |
| N3 | C18 | H181 | 111.5° | 109.7° |
| N3 | C18 | H182 | 112.7° | 109.6° |
| C18 | N3 | C25 | 116.8° | 120.9° |
| H181 | C18 | H182 | 105.1° | 109.8° |
| N3 | C25 | O1 | 126.7° | 120.0° |
| N3 | C25 | C26 | 117.7° | 120.0° |
| O1 | C25 | C26 | 115.6° | 120.0° |
| C25 | C26 | H261 | 109.5° | 109.5° |
| C25 | C26 | H262 | 109.4° | 109.4° |
| C25 | C26 | H263 | 109.5° | 109.4° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| H261 | C26 | H263 | 109.4° | 109.6° |
| H262 | C26 | H263 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C1 | C6 | C2 | 179.1° | 179.7° |
| C10 | C1 | C2 | C3 | 178.4° | 179.9° |
| C10 | C1 | C2 | H2 | 1.6° | 0.0° |
| C10 | C1 | C6 | C5 | 177.8° | 179.7° |
| C10 | C1 | C6 | H6 | 2.3° | 0.0° |
| C1 | C10 | H101 | H102 | 120.0° | 120.0° |
| C1 | C10 | H101 | H103 | 120.0° | 119.9° |
| C1 | C10 | H102 | H103 | 120.0° | 120.0° |
| C6 | C1 | C2 | C3 | 0.6° | 0.3° |
| C6 | C1 | C2 | H2 | 179.5° | 179.8° |
| C1 | C6 | C5 | C4 | 3.0° | 0.5° |
| C1 | C6 | C5 | H6 | 180.0° | 179.7° |
| C1 | C6 | C5 | H5 | 177.0° | 179.7° |
| C6 | C1 | C10 | H101 | 126.0° | 90.0° |
| C6 | C1 | C10 | H102 | 6.1° | 150.0° |
| C6 | C1 | C10 | H103 | 114.0° | 30.0° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 1.7° | 0.1° |
| C1 | C2 | C3 | N4 | 179.7° | 180.0° |
| C2 | C1 | C6 | C5 | 1.3° | 0.6° |
| C2 | C1 | C6 | H6 | 178.7° | 179.7° |
| C2 | C1 | C10 | H101 | 52.9° | 89.8° |
| C2 | C1 | C10 | H102 | 172.9° | 30.2° |
| C2 | C1 | C10 | H103 | 67.1° | 150.3° |
| C2 | C3 | C4 | N4 | 178.4° | 179.9° |
| C2 | C3 | C4 | C5 | 3.9° | 0.0° |
| C2 | C3 | C4 | F40 | 177.9° | 180.0° |
| C2 | C3 | N4 | N1 | 27.1° | 95.0° |
| C2 | C3 | N4 | C14 | 161.2° | 85.3° |
| H2 | C2 | C3 | C4 | 178.3° | 179.9° |
| H2 | C2 | C3 | N4 | 0.3° | 0.1° |
| C3 | C4 | C5 | F40 | 178.3° | 180.0° |
| C3 | C4 | C5 | C6 | 4.4° | 0.3° |
| C3 | C4 | C5 | H5 | 175.5° | 180.0° |
| C4 | C3 | N4 | N1 | 154.5° | 85.0° |
| C4 | C3 | N4 | C14 | 17.2° | 94.7° |
| N4 | C3 | C4 | C5 | 177.7° | 180.0° |
| N4 | C3 | C4 | F40 | 0.5° | 0.0° |
| C3 | N4 | N1 | C14 | 173.6° | 179.7° |
| C3 | N4 | N1 | C24 | 174.5° | 180.0° |
| C3 | N4 | C14 | C13 | 169.1° | 179.9° |
| C3 | N4 | C14 | H141 | 49.1° | 61.6° |
| C3 | N4 | C14 | H142 | 69.1° | 61.7° |
| C4 | C5 | C6 | H5 | 180.0° | 179.7° |
| C4 | C5 | C6 | H6 | 177.0° | 179.7° |
| F40 | C4 | C5 | C6 | 177.2° | 179.7° |
| F40 | C4 | C5 | H5 | 2.8° | 0.0° |
| H5 | C5 | C6 | H6 | 3.0° | 0.0° |
| N4 | N1 | C24 | C13 | 0.6° | 0.0° |
| N4 | N1 | C24 | C29 | 179.0° | 180.0° |
| N1 | N4 | C14 | C13 | 17.8° | 0.3° |
| N1 | N4 | C14 | H141 | 137.8° | 118.1° |
| N1 | N4 | C14 | H142 | 103.9° | 118.6° |
| C14 | N4 | N1 | C24 | 11.9° | 0.2° |
| N4 | C14 | C13 | C24 | 18.5° | 0.3° |
| N4 | C14 | C13 | C7 | 95.3° | 118.4° |
| N4 | C14 | C13 | H141 | 120.0° | 118.4° |
| N4 | C14 | C13 | H142 | 121.8° | 118.4° |
| N4 | C14 | C13 | C17 | 133.9° | 118.0° |
| N4 | C14 | H141 | H142 | 121.9° | 123.3° |
| N1 | C24 | C13 | C29 | 178.1° | 180.0° |
| N1 | C24 | C13 | C7 | 108.3° | 118.1° |
| N1 | C24 | C13 | C14 | 11.8° | 0.2° |
| N1 | C24 | C13 | C17 | 119.7° | 118.3° |
| N1 | C24 | C29 | C9 | 3.8° | 5.0° |
| N1 | C24 | C29 | O39 | 176.4° | 175.1° |
| C24 | C13 | C7 | C14 | 112.0° | 112.5° |
| C24 | C13 | C7 | C17 | 127.0° | 123.6° |
| C24 | C13 | C14 | C17 | 115.5° | 118.3° |
| C24 | C13 | C14 | H141 | 138.5° | 118.1° |
| C24 | C13 | C14 | H142 | 103.3° | 118.6° |
| C24 | C13 | C17 | C19 | 138.9° | 55.3° |
| C24 | C13 | C17 | C23 | 41.4° | 124.4° |
| C13 | C24 | C29 | C9 | 178.4° | 175.1° |
| C13 | C24 | C29 | O39 | 1.4° | 4.9° |
| C24 | C13 | C7 | C8 | 43.0° | 54.8° |
| C24 | C13 | C7 | H71 | 163.0° | 174.7° |
| C24 | C13 | C7 | H72 | 75.6° | 65.3° |
| C29 | C24 | C13 | C7 | 69.8° | 61.8° |
| C29 | C24 | C13 | C14 | 170.1° | 179.8° |
| C29 | C24 | C13 | C17 | 62.2° | 61.8° |
| C24 | C29 | C9 | O39 | 179.8° | 179.9° |
| C24 | C29 | C9 | H91 | 129.5° | 0.0° |
| C24 | C29 | C9 | H92 | 9.5° | 120.0° |
| C24 | C29 | C9 | H93 | 110.5° | 120.0° |
| C7 | C13 | C14 | C17 | 130.8° | 123.6° |
| C7 | C13 | C14 | H141 | 24.7° | 0.0° |
| C7 | C13 | C14 | H142 | 142.9° | 123.3° |
| C7 | C13 | C17 | C19 | 14.7° | 178.9° |
| C7 | C13 | C17 | C23 | 165.6° | 0.8° |
| C13 | C7 | C8 | H71 | 120.0° | 120.0° |
| C13 | C7 | C8 | H72 | 118.5° | 120.0° |
| C13 | C7 | H71 | H72 | 118.6° | 120.0° |
| C13 | C7 | C8 | C11 | 173.5° | 177.2° |
| C13 | C7 | C8 | H81 | 53.5° | 62.8° |
| C13 | C7 | C8 | H82 | 69.8° | 57.2° |
| C13 | C14 | H141 | H142 | 121.9° | 123.2° |
| C14 | C13 | C17 | C19 | 112.5° | 57.5° |
| C14 | C13 | C17 | C23 | 67.2° | 122.8° |
| C14 | C13 | C7 | C8 | 69.0° | 57.8° |
| C14 | C13 | C7 | H71 | 51.0° | 62.2° |
| C14 | C13 | C7 | H72 | 172.4° | 177.9° |
| C17 | C13 | C14 | H141 | 106.1° | 123.6° |
| C17 | C13 | C14 | H142 | 12.1° | 0.4° |
| C13 | C17 | C19 | C23 | 179.7° | 179.7° |
| C13 | C17 | C19 | C20 | 179.3° | 180.0° |
| C13 | C17 | C19 | H19 | 0.7° | 0.0° |
| C13 | C17 | C23 | C22 | 179.6° | 179.8° |
| C13 | C17 | C23 | H23 | 0.3° | 0.0° |
| C17 | C13 | C7 | C8 | 170.0° | 178.4° |
| C17 | C13 | C7 | H71 | 70.0° | 61.6° |
| C17 | C13 | C7 | H72 | 51.5° | 58.3° |
| C17 | C19 | C20 | H19 | 180.0° | 180.0° |
| C17 | C19 | C20 | C21 | 1.1° | 0.0° |
| C17 | C19 | C20 | H20 | 178.9° | 180.0° |
| C19 | C17 | C23 | C22 | 0.1° | 0.5° |
| C19 | C17 | C23 | H23 | 179.9° | 179.7° |
| C23 | C17 | C19 | C20 | 0.4° | 0.3° |
| C23 | C17 | C19 | H19 | 179.6° | 179.7° |
| C17 | C23 | C22 | C21 | 0.4° | 0.4° |
| C17 | C23 | C22 | H23 | 180.0° | 179.8° |
| C17 | C23 | C22 | H22 | 179.6° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 1.6° | 0.0° |
| C19 | C20 | C21 | H21 | 178.4° | 180.0° |
| H19 | C19 | C20 | C21 | 178.9° | 180.0° |
| H19 | C19 | C20 | H20 | 1.1° | 0.0° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 1.2° | 0.1° |
| C20 | C21 | C22 | H22 | 178.8° | 180.0° |
| H20 | C20 | C21 | C22 | 178.4° | 180.0° |
| H20 | C20 | C21 | H21 | 1.6° | 0.0° |
| C21 | C22 | C23 | H22 | 180.0° | 179.9° |
| C21 | C22 | C23 | H23 | 179.6° | 179.8° |
| H21 | C21 | C22 | C23 | 178.8° | 179.8° |
| H21 | C21 | C22 | H22 | 1.1° | 0.1° |
| H22 | C22 | C23 | H23 | 0.4° | 0.1° |
| C29 | C9 | H91 | H92 | 120.0° | 120.0° |
| C29 | C9 | H91 | H93 | 120.0° | 120.1° |
| C29 | C9 | H92 | H93 | 120.0° | 120.1° |
| O39 | C29 | C9 | H91 | 50.3° | 180.0° |
| O39 | C29 | C9 | H92 | 170.3° | 60.1° |
| O39 | C29 | C9 | H93 | 69.7° | 60.0° |
| H91 | C9 | H92 | H93 | 120.0° | 119.9° |
| H101 | C10 | H102 | H103 | 120.0° | 120.0° |
| C8 | C7 | H71 | H72 | 118.6° | 120.0° |
| C7 | C8 | C11 | H81 | 120.0° | 120.0° |
| C7 | C8 | C11 | H82 | 116.7° | 120.1° |
| C7 | C8 | H81 | H82 | 117.1° | 120.0° |
| C7 | C8 | C11 | N2 | 127.3° | 180.0° |
| C7 | C8 | C11 | H111 | 7.3° | 60.1° |
| C7 | C8 | C11 | H112 | 112.1° | 59.9° |
| H71 | C7 | C8 | C11 | 66.5° | 57.2° |
| H71 | C7 | C8 | H81 | 173.5° | 177.2° |
| H71 | C7 | C8 | H82 | 50.2° | 62.8° |
| H72 | C7 | C8 | C11 | 55.0° | 62.7° |
| H72 | C7 | C8 | H81 | 65.0° | 57.2° |
| H72 | C7 | C8 | H82 | 171.7° | 177.2° |
| C11 | C8 | H81 | H82 | 117.1° | 120.0° |
| C8 | C11 | N2 | H111 | 120.0° | 120.0° |
| C8 | C11 | N2 | H112 | 120.6° | 120.1° |
| C8 | C11 | H111 | H112 | 120.6° | 120.0° |
| C8 | C11 | N2 | C15 | 98.0° | 170.0° |
| C8 | C11 | N2 | C12 | 132.0° | 65.7° |
| H81 | C8 | C11 | N2 | 112.7° | 60.0° |
| H81 | C8 | C11 | H111 | 127.3° | 180.0° |
| H81 | C8 | C11 | H112 | 7.9° | 60.1° |
| H82 | C8 | C11 | N2 | 10.5° | 60.0° |
| H82 | C8 | C11 | H111 | 109.5° | 60.0° |
| H82 | C8 | C11 | H112 | 131.2° | 180.0° |
| N2 | C11 | H111 | H112 | 120.7° | 120.0° |
| C11 | N2 | C15 | C12 | 126.1° | 124.1° |
| C11 | N2 | C12 | C18 | 61.6° | 172.7° |
| C11 | N2 | C12 | H121 | 178.5° | 52.7° |
| C11 | N2 | C12 | H122 | 61.4° | 67.3° |
| C11 | N2 | C15 | C16 | 71.2° | 172.8° |
| C11 | N2 | C15 | H151 | 48.8° | 67.3° |
| C11 | N2 | C15 | H152 | 168.7° | 52.8° |
| H111 | C11 | N2 | C15 | 142.0° | 70.0° |
| H111 | C11 | N2 | C12 | 12.0° | 54.3° |
| H112 | C11 | N2 | C15 | 22.6° | 50.0° |
| H112 | C11 | N2 | C12 | 107.4° | 174.3° |
| C15 | N2 | C12 | C18 | 67.5° | 63.1° |
| C15 | N2 | C12 | H121 | 52.5° | 176.9° |
| C15 | N2 | C12 | H122 | 169.5° | 56.9° |
| N2 | C15 | C16 | H151 | 120.0° | 119.9° |
| N2 | C15 | C16 | H152 | 120.0° | 120.0° |
| N2 | C15 | H151 | H152 | 120.1° | 120.1° |
| N2 | C15 | C16 | N3 | 43.9° | 53.8° |
| N2 | C15 | C16 | H161 | 76.1° | 173.6° |
| N2 | C15 | C16 | H162 | 163.5° | 65.9° |
| N2 | C12 | C18 | H121 | 120.0° | 120.0° |
| N2 | C12 | C18 | H122 | 122.9° | 119.9° |
| N2 | C12 | H121 | H122 | 123.4° | 120.0° |
| C12 | N2 | C15 | C16 | 54.9° | 63.1° |
| C12 | N2 | C15 | H151 | 174.9° | 56.9° |
| C12 | N2 | C15 | H152 | 65.2° | 177.0° |
| N2 | C12 | C18 | N3 | 70.5° | 53.9° |
| N2 | C12 | C18 | H181 | 169.5° | 65.9° |
| N2 | C12 | C18 | H182 | 51.6° | 173.6° |
| C18 | C12 | H121 | H122 | 123.4° | 120.1° |
| C12 | C18 | N3 | C16 | 69.8° | 51.2° |
| C12 | C18 | N3 | H181 | 120.0° | 119.8° |
| C12 | C18 | N3 | H182 | 122.1° | 119.7° |
| C12 | C18 | H181 | H182 | 122.4° | 120.4° |
| C12 | C18 | N3 | C25 | 107.9° | 128.8° |
| H121 | C12 | C18 | N3 | 49.5° | 173.8° |
| H121 | C12 | C18 | H181 | 70.5° | 54.1° |
| H121 | C12 | C18 | H182 | 171.6° | 66.5° |
| H122 | C12 | C18 | N3 | 166.5° | 66.1° |
| H122 | C12 | C18 | H181 | 46.6° | 174.1° |
| H122 | C12 | C18 | H182 | 71.3° | 53.6° |
| C16 | C15 | H151 | H152 | 120.1° | 120.1° |
| C15 | C16 | N3 | H161 | 120.0° | 119.7° |
| C15 | C16 | N3 | H162 | 119.6° | 119.7° |
| C15 | C16 | H161 | H162 | 119.7° | 120.4° |
| C15 | C16 | N3 | C18 | 56.0° | 51.2° |
| C15 | C16 | N3 | C25 | 121.4° | 128.8° |
| H151 | C15 | C16 | N3 | 163.9° | 66.1° |
| H151 | C15 | C16 | H161 | 43.9° | 53.6° |
| H151 | C15 | C16 | H162 | 76.5° | 174.2° |
| H152 | C15 | C16 | N3 | 76.2° | 173.8° |
| H152 | C15 | C16 | H161 | 163.9° | 66.4° |
| H152 | C15 | C16 | H162 | 43.5° | 54.1° |
| N3 | C16 | H161 | H162 | 119.6° | 120.5° |
| C16 | N3 | C18 | C25 | 177.8° | 180.0° |
| C16 | N3 | C18 | H181 | 170.2° | 68.6° |
| C16 | N3 | C18 | H182 | 52.3° | 170.9° |
| C16 | N3 | C25 | O1 | 1.1° | 5.0° |
| C16 | N3 | C25 | C26 | 179.2° | 175.0° |
| H161 | C16 | N3 | C18 | 64.0° | 170.9° |
| H161 | C16 | N3 | C25 | 118.6° | 9.1° |
| H162 | C16 | N3 | C18 | 175.6° | 68.5° |
| H162 | C16 | N3 | C25 | 1.8° | 111.5° |
| N3 | C18 | H181 | H182 | 122.3° | 120.5° |
| C18 | N3 | C25 | O1 | 178.4° | 175.0° |
| C18 | N3 | C25 | C26 | 3.5° | 5.0° |
| H181 | C18 | N3 | C25 | 12.1° | 111.4° |
| H182 | C18 | N3 | C25 | 129.9° | 9.1° |
| N3 | C25 | O1 | C26 | 178.1° | 180.0° |
| N3 | C25 | C26 | H261 | 153.6° | 5.0° |
| N3 | C25 | C26 | H262 | 33.5° | 125.0° |
| N3 | C25 | C26 | H263 | 86.5° | 115.1° |
| O1 | C25 | C26 | H261 | 28.1° | 175.0° |
| O1 | C25 | C26 | H262 | 148.1° | 55.0° |
| O1 | C25 | C26 | H263 | 91.9° | 64.9° |
| C25 | C26 | H261 | H262 | 120.0° | 120.0° |
| C25 | C26 | H261 | H263 | 120.0° | 120.0° |
| C25 | C26 | H262 | H263 | 120.0° | 119.9° |
| H261 | C26 | H262 | H263 | 120.0° | 120.1° |
