C1N
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.39Å | 1.43Å | Aromatic |
| C1 | C6 | sing | 1.39Å | 1.44Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.08Å | |
| C2 | C3 | sing | 1.40Å | 1.43Å | Aromatic |
| C2 | H2 | sing | 1.09Å | 1.08Å | |
| C3 | C4 | doub | 1.40Å | 1.43Å | Aromatic |
| C3 | H3 | sing | 1.09Å | 1.08Å | |
| C4 | C5 | sing | 1.40Å | 1.43Å | Aromatic |
| C4 | H4 | sing | 1.09Å | 1.08Å | |
| C5 | C6 | doub | 1.39Å | 1.43Å | Aromatic |
| C5 | H5 | sing | 1.09Å | 1.08Å | |
| C6 | C7 | sing | 1.50Å | 1.54Å | |
| C7 | O8 | sing | 1.43Å | 1.46Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.10Å | 1.10Å | |
| O8 | C9 | sing | 1.37Å | 1.36Å | |
| C9 | O10 | doub | 1.23Å | 1.23Å | |
| C9 | N11 | sing | 1.38Å | 1.36Å | |
| N11 | C12 | sing | 1.44Å | 1.50Å | |
| N11 | H11 | sing | 1.02Å | 1.00Å | |
| C12 | C16 | sing | 1.53Å | 1.68Å | |
| C12 | C17 | sing | 1.53Å | 1.61Å | |
| C12 | H12 | sing | 1.10Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C13 | C15 | sing | 1.53Å | 1.55Å | |
| C13 | C17 | sing | 1.54Å | 1.59Å | |
| C13 | H13 | sing | 1.10Å | 1.10Å | |
| C14 | H141 | sing | 1.10Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.10Å | 1.10Å | |
| C15 | H151 | sing | 1.10Å | 1.10Å | |
| C15 | H152 | sing | 1.10Å | 1.10Å | |
| C15 | H153 | sing | 1.09Å | 1.10Å | |
| C16 | O18 | doub | 1.23Å | 1.20Å | |
| C16 | N19 | sing | 1.39Å | 1.36Å | |
| C17 | H171 | sing | 1.10Å | 1.10Å | |
| C17 | H172 | sing | 1.10Å | 1.10Å | |
| N19 | C20 | sing | 1.44Å | 1.50Å | |
| N19 | H19 | sing | 1.02Å | 1.00Å | |
| C20 | C21 | sing | 1.53Å | 1.58Å | |
| C20 | C25 | sing | 1.53Å | 1.52Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.54Å | 1.58Å | |
| C21 | H211 | sing | 1.10Å | 1.10Å | |
| C21 | H212 | sing | 1.10Å | 1.10Å | |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C22 | C24 | sing | 1.53Å | 1.55Å | |
| C22 | H22 | sing | 1.10Å | 1.10Å | |
| C23 | H231 | sing | 1.10Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.10Å | 1.10Å | |
| C24 | H242 | sing | 1.10Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C25 | N26 | sing | 1.39Å | 1.37Å | |
| C25 | O29 | doub | 1.23Å | 1.25Å | |
| N26 | C27 | sing | 1.44Å | 1.49Å | |
| N26 | H26 | sing | 1.02Å | 1.00Å | |
| C27 | C28 | sing | 1.53Å | 1.56Å | |
| C27 | C30 | sing | 1.52Å | 1.53Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | C33 | sing | 1.51Å | 1.54Å | |
| C28 | H281 | sing | 1.10Å | 1.10Å | |
| C28 | H282 | sing | 1.10Å | 1.10Å | |
| C30 | O31 | doub | 1.23Å | 1.22Å | |
| C30 | C32 | sing | 1.51Å | 1.49Å | |
| C32 | F1 | sing | 1.36Å | 46.08Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C33 | C35 | sing | 1.39Å | 1.43Å | Aromatic |
| C33 | C39 | doub | 1.39Å | 1.42Å | Aromatic |
| C35 | C36 | doub | 1.40Å | 1.42Å | Aromatic |
| C35 | H35 | sing | 1.09Å | 1.08Å | |
| C36 | C37 | sing | 1.39Å | 1.42Å | Aromatic |
| C36 | H36 | sing | 1.09Å | 1.08Å | |
| C37 | C38 | doub | 1.39Å | 1.42Å | Aromatic |
| C37 | O40 | sing | 1.36Å | 1.39Å | |
| C38 | C39 | sing | 1.39Å | 1.42Å | Aromatic |
| C38 | H38 | sing | 1.09Å | 1.08Å | |
| C39 | H39 | sing | 1.09Å | 1.08Å | |
| O40 | H40 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 120.7° | 119.7° |
| C2 | C1 | H1 | 119.7° | 119.4° |
| C1 | C2 | C3 | 119.8° | 120.0° |
| C1 | C2 | H2 | 120.1° | 120.0° |
| C6 | C1 | H1 | 119.7° | 120.8° |
| C1 | C6 | C5 | 119.4° | 120.6° |
| C1 | C6 | C7 | 118.2° | 119.7° |
| C3 | C2 | H2 | 120.1° | 120.0° |
| C2 | C3 | C4 | 119.8° | 120.0° |
| C2 | C3 | H3 | 120.1° | 120.0° |
| C4 | C3 | H3 | 120.1° | 120.0° |
| C3 | C4 | C5 | 120.4° | 120.0° |
| C3 | C4 | H4 | 119.8° | 120.0° |
| C5 | C4 | H4 | 119.8° | 120.0° |
| C4 | C5 | C6 | 119.9° | 119.7° |
| C4 | C5 | H5 | 120.0° | 119.5° |
| C6 | C5 | H5 | 120.0° | 120.9° |
| C5 | C6 | C7 | 122.4° | 119.7° |
| C6 | C7 | O8 | 109.9° | 109.1° |
| C6 | C7 | H71 | 109.2° | 111.0° |
| C6 | C7 | H72 | 109.4° | 110.7° |
| O8 | C7 | H71 | 109.2° | 109.1° |
| O8 | C7 | H72 | 109.3° | 109.1° |
| C7 | O8 | C9 | 114.5° | 115.9° |
| H71 | C7 | H72 | 109.8° | 107.9° |
| O8 | C9 | O10 | 121.5° | 124.6° |
| O8 | C9 | N11 | 119.9° | 109.8° |
| O10 | C9 | N11 | 118.5° | 125.6° |
| C9 | N11 | C12 | 124.4° | 123.9° |
| C9 | N11 | H11 | 117.8° | 118.0° |
| C12 | N11 | H11 | 117.8° | 118.1° |
| N11 | C12 | C16 | 102.7° | 107.1° |
| N11 | C12 | C17 | 112.7° | 112.3° |
| N11 | C12 | H12 | 113.9° | 107.0° |
| C16 | C12 | C17 | 115.0° | 110.2° |
| C16 | C12 | H12 | 111.6° | 108.7° |
| C12 | C16 | O18 | 97.1° | 123.0° |
| C12 | C16 | N19 | 124.5° | 112.2° |
| C17 | C12 | H12 | 101.4° | 111.4° |
| C12 | C17 | C13 | 119.1° | 114.8° |
| C12 | C17 | H171 | 104.1° | 108.9° |
| C12 | C17 | H172 | 106.4° | 109.3° |
| C14 | C13 | C15 | 106.6° | 109.7° |
| C14 | C13 | C17 | 112.9° | 109.7° |
| C14 | C13 | H13 | 109.0° | 107.6° |
| C13 | C14 | H141 | 109.4° | 110.8° |
| C13 | C14 | H142 | 109.5° | 110.8° |
| C13 | C14 | H143 | 109.5° | 111.3° |
| C15 | C13 | C17 | 109.0° | 112.3° |
| C15 | C13 | H13 | 112.8° | 108.3° |
| C13 | C15 | H151 | 109.5° | 111.3° |
| C13 | C15 | H152 | 109.5° | 110.7° |
| C13 | C15 | H153 | 109.5° | 111.4° |
| C17 | C13 | H13 | 106.6° | 109.1° |
| C13 | C17 | H171 | 104.1° | 108.7° |
| C13 | C17 | H172 | 106.4° | 109.0° |
| H141 | C14 | H142 | 109.5° | 107.7° |
| H141 | C14 | H143 | 109.5° | 108.0° |
| H142 | C14 | H143 | 109.5° | 108.1° |
| H151 | C15 | H152 | 109.5° | 107.9° |
| H151 | C15 | H153 | 109.5° | 108.2° |
| H152 | C15 | H153 | 109.5° | 107.1° |
| O18 | C16 | N19 | 110.7° | 124.8° |
| C16 | N19 | C20 | 115.8° | 123.5° |
| C16 | N19 | H19 | 122.1° | 118.8° |
| H171 | C17 | H172 | 117.4° | 105.7° |
| C20 | N19 | H19 | 122.1° | 117.7° |
| N19 | C20 | C21 | 114.1° | 112.2° |
| N19 | C20 | C25 | 103.4° | 107.2° |
| N19 | C20 | H20 | 112.3° | 107.0° |
| C21 | C20 | C25 | 114.1° | 110.2° |
| C21 | C20 | H20 | 101.2° | 111.4° |
| C20 | C21 | C22 | 121.5° | 114.8° |
| C20 | C21 | H211 | 102.8° | 108.9° |
| C20 | C21 | H212 | 105.6° | 109.3° |
| C25 | C20 | H20 | 112.3° | 108.7° |
| C20 | C25 | N26 | 114.1° | 112.0° |
| C20 | C25 | O29 | 122.5° | 123.0° |
| C22 | C21 | H211 | 102.8° | 108.6° |
| C22 | C21 | H212 | 105.6° | 109.0° |
| C21 | C22 | C23 | 116.5° | 109.7° |
| C21 | C22 | C24 | 111.6° | 112.4° |
| C21 | C22 | H22 | 102.8° | 109.2° |
| H211 | C21 | H212 | 119.5° | 105.8° |
| C23 | C22 | C24 | 109.4° | 109.7° |
| C23 | C22 | H22 | 105.3° | 107.5° |
| C22 | C23 | H231 | 109.4° | 110.8° |
| C22 | C23 | H232 | 109.5° | 110.8° |
| C22 | C23 | H233 | 109.5° | 111.3° |
| C24 | C22 | H22 | 110.9° | 108.3° |
| C22 | C24 | H241 | 109.5° | 111.2° |
| C22 | C24 | H242 | 109.4° | 110.7° |
| C22 | C24 | H243 | 109.5° | 111.4° |
| H231 | C23 | H232 | 109.5° | 107.7° |
| H231 | C23 | H233 | 109.4° | 108.0° |
| H232 | C23 | H233 | 109.5° | 108.1° |
| H241 | C24 | H242 | 109.5° | 108.0° |
| H241 | C24 | H243 | 109.5° | 108.2° |
| H242 | C24 | H243 | 109.5° | 107.1° |
| N26 | C25 | O29 | 123.4° | 124.9° |
| C25 | N26 | C27 | 121.2° | 123.3° |
| C25 | N26 | H26 | 119.4° | 119.3° |
| C27 | N26 | H26 | 119.4° | 117.5° |
| N26 | C27 | C28 | 110.2° | 112.7° |
| N26 | C27 | C30 | 107.8° | 106.6° |
| N26 | C27 | H27 | 111.4° | 106.6° |
| C28 | C27 | C30 | 113.0° | 110.1° |
| C28 | C27 | H27 | 105.9° | 111.8° |
| C27 | C28 | C33 | 110.3° | 112.7° |
| C27 | C28 | H281 | 109.0° | 110.4° |
| C27 | C28 | H282 | 109.2° | 110.1° |
| C30 | C27 | H27 | 108.5° | 109.0° |
| C27 | C30 | O31 | 121.1° | 122.5° |
| C27 | C30 | C32 | 119.9° | 116.5° |
| C33 | C28 | H281 | 109.0° | 109.7° |
| C33 | C28 | H282 | 109.2° | 108.4° |
| C28 | C33 | C35 | 120.9° | 119.4° |
| C28 | C33 | C39 | 120.1° | 119.4° |
| H281 | C28 | H282 | 110.1° | 105.2° |
| O31 | C30 | C32 | 118.9° | 121.0° |
| C30 | C32 | F1 | 110.1° | 111.2° |
| C30 | C32 | H321 | 109.1° | 109.7° |
| C30 | C32 | H322 | 109.2° | 109.8° |
| F1 | C32 | H321 | 109.1° | 107.9° |
| F1 | C32 | H322 | 109.2° | 107.9° |
| H321 | C32 | H322 | 110.0° | 110.3° |
| C35 | C33 | C39 | 119.0° | 121.3° |
| C33 | C35 | C36 | 120.3° | 119.4° |
| C33 | C35 | H35 | 119.9° | 121.2° |
| C33 | C39 | C38 | 120.6° | 119.3° |
| C33 | C39 | H39 | 119.7° | 121.1° |
| C36 | C35 | H35 | 119.8° | 119.4° |
| C35 | C36 | C37 | 120.3° | 120.0° |
| C35 | C36 | H36 | 119.8° | 119.6° |
| C37 | C36 | H36 | 119.9° | 120.4° |
| C36 | C37 | C38 | 119.5° | 120.0° |
| C36 | C37 | O40 | 121.4° | 120.0° |
| C38 | C37 | O40 | 119.1° | 120.0° |
| C37 | C38 | C39 | 120.3° | 120.1° |
| C37 | C38 | H38 | 119.9° | 120.3° |
| C37 | O40 | H40 | 109.5° | 110.3° |
| C39 | C38 | H38 | 119.8° | 119.6° |
| C38 | C39 | H39 | 119.7° | 119.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.9° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.0° | 0.0° |
| C1 | C2 | C3 | H3 | 180.0° | 180.0° |
| C2 | C1 | C6 | C5 | 0.1° | 0.0° |
| C2 | C1 | C6 | C7 | 179.8° | 179.9° |
| C6 | C1 | C2 | C3 | 0.1° | 0.0° |
| C6 | C1 | C2 | H2 | 179.9° | 180.0° |
| C1 | C6 | C5 | C4 | 0.1° | 0.1° |
| C1 | C6 | C5 | C7 | 179.7° | 179.9° |
| C1 | C6 | C5 | H5 | 180.0° | 180.0° |
| C1 | C6 | C7 | O8 | 118.3° | 90.0° |
| C1 | C6 | C7 | H71 | 1.5° | 30.2° |
| C1 | C6 | C7 | H72 | 121.7° | 149.9° |
| H1 | C1 | C2 | C3 | 179.9° | 180.0° |
| H1 | C1 | C2 | H2 | 0.1° | 0.1° |
| H1 | C1 | C6 | C5 | 179.9° | 179.9° |
| H1 | C1 | C6 | C7 | 0.2° | 0.0° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.0° | 0.0° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| H2 | C2 | C3 | C4 | 180.0° | 180.0° |
| H2 | C2 | C3 | H3 | 0.0° | 0.1° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.0° | 0.1° |
| C3 | C4 | C5 | H5 | 180.0° | 180.0° |
| H3 | C3 | C4 | C5 | 180.0° | 180.0° |
| H3 | C3 | C4 | H4 | 0.0° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 179.7° | 180.0° |
| H4 | C4 | C5 | C6 | 180.0° | 180.0° |
| H4 | C4 | C5 | H5 | 0.0° | 0.0° |
| C5 | C6 | C7 | O8 | 62.0° | 89.9° |
| C5 | C6 | C7 | H71 | 178.1° | 149.9° |
| C5 | C6 | C7 | H72 | 57.9° | 30.2° |
| H5 | C5 | C6 | C7 | 0.3° | 0.1° |
| C6 | C7 | O8 | H71 | 119.8° | 121.4° |
| C6 | C7 | O8 | H72 | 120.0° | 121.0° |
| C6 | C7 | H71 | H72 | 119.9° | 121.4° |
| C6 | C7 | O8 | C9 | 178.4° | 180.0° |
| O8 | C7 | H71 | H72 | 119.9° | 118.4° |
| C7 | O8 | C9 | O10 | 0.4° | 0.0° |
| C7 | O8 | C9 | N11 | 179.0° | 180.0° |
| H71 | C7 | O8 | C9 | 58.6° | 58.7° |
| H72 | C7 | O8 | C9 | 61.6° | 58.9° |
| O8 | C9 | O10 | N11 | 178.7° | 180.0° |
| O8 | C9 | N11 | C12 | 2.0° | 180.0° |
| O8 | C9 | N11 | H11 | 178.0° | 0.1° |
| O10 | C9 | N11 | C12 | 179.3° | 0.1° |
| O10 | C9 | N11 | H11 | 0.7° | 180.0° |
| C9 | N11 | C12 | H11 | 180.0° | 179.9° |
| C9 | N11 | C12 | C16 | 174.8° | 146.5° |
| C9 | N11 | C12 | C17 | 60.9° | 92.4° |
| C9 | N11 | C12 | H12 | 53.9° | 30.0° |
| N11 | C12 | C16 | C17 | 122.7° | 122.4° |
| N11 | C12 | C16 | H12 | 122.5° | 115.3° |
| N11 | C12 | C17 | H12 | 122.2° | 119.9° |
| N11 | C12 | C17 | C13 | 169.4° | 178.7° |
| N11 | C12 | C16 | O18 | 78.1° | 34.8° |
| N11 | C12 | C16 | N19 | 43.1° | 143.0° |
| N11 | C12 | C17 | H171 | 54.0° | 59.3° |
| N11 | C12 | C17 | H172 | 70.6° | 55.8° |
| H11 | N11 | C12 | C16 | 5.2° | 33.6° |
| H11 | N11 | C12 | C17 | 119.1° | 87.5° |
| H11 | N11 | C12 | H12 | 126.0° | 150.0° |
| C16 | C12 | C17 | H12 | 120.6° | 120.8° |
| C16 | C12 | C17 | C13 | 52.2° | 62.0° |
| C12 | C16 | O18 | N19 | 131.1° | 177.5° |
| C16 | C12 | C17 | H171 | 63.2° | 60.1° |
| C16 | C12 | C17 | H172 | 172.2° | 175.1° |
| C12 | C16 | N19 | C20 | 128.1° | 177.7° |
| C12 | C16 | N19 | H19 | 51.9° | 1.6° |
| C12 | C17 | C13 | C14 | 100.2° | 57.9° |
| C12 | C17 | C13 | C15 | 141.5° | 64.4° |
| C12 | C17 | C13 | H171 | 115.4° | 122.2° |
| C12 | C17 | C13 | H172 | 120.0° | 123.0° |
| C12 | C17 | C13 | H13 | 19.5° | 175.5° |
| C17 | C12 | C16 | O18 | 44.7° | 87.7° |
| C17 | C12 | C16 | N19 | 165.9° | 94.6° |
| C12 | C17 | H171 | H172 | 117.2° | 117.4° |
| H12 | C12 | C17 | C13 | 68.4° | 58.8° |
| H12 | C12 | C16 | O18 | 159.5° | 150.0° |
| H12 | C12 | C16 | N19 | 79.3° | 27.7° |
| H12 | C12 | C17 | H171 | 176.3° | 179.2° |
| H12 | C12 | C17 | H172 | 51.7° | 64.1° |
| C14 | C13 | C15 | C17 | 122.1° | 122.3° |
| C14 | C13 | C15 | H13 | 119.6° | 117.1° |
| C14 | C13 | C17 | H13 | 119.6° | 117.6° |
| C13 | C14 | H141 | H142 | 120.0° | 121.3° |
| C13 | C14 | H141 | H143 | 120.0° | 122.2° |
| C13 | C14 | H142 | H143 | 120.0° | 122.2° |
| C14 | C13 | C15 | H151 | 148.1° | 66.6° |
| C14 | C13 | C15 | H152 | 91.9° | 53.4° |
| C14 | C13 | C15 | H153 | 28.1° | 172.5° |
| C14 | C13 | C17 | H171 | 15.2° | 179.9° |
| C14 | C13 | C17 | H172 | 139.8° | 65.1° |
| C15 | C13 | C17 | H13 | 122.1° | 120.1° |
| C15 | C13 | C14 | H141 | 146.3° | 58.3° |
| C15 | C13 | C14 | H142 | 26.3° | 177.8° |
| C15 | C13 | C14 | H143 | 93.7° | 61.9° |
| C13 | C15 | H151 | H152 | 120.0° | 121.7° |
| C13 | C15 | H151 | H153 | 120.0° | 122.7° |
| C13 | C15 | H152 | H153 | 120.0° | 121.6° |
| C15 | C13 | C17 | H171 | 103.1° | 57.8° |
| C15 | C13 | C17 | H172 | 21.5° | 172.6° |
| C17 | C13 | C14 | H141 | 26.6° | 177.8° |
| C17 | C13 | C14 | H142 | 93.4° | 58.4° |
| C17 | C13 | C14 | H143 | 146.6° | 62.0° |
| C17 | C13 | C15 | H151 | 25.9° | 55.7° |
| C17 | C13 | C15 | H152 | 145.9° | 175.7° |
| C17 | C13 | C15 | H153 | 94.1° | 65.2° |
| C13 | C17 | H171 | H172 | 117.3° | 116.9° |
| H13 | C13 | C14 | H141 | 91.7° | 59.2° |
| H13 | C13 | C14 | H142 | 148.3° | 60.2° |
| H13 | C13 | C14 | H143 | 28.3° | 179.5° |
| H13 | C13 | C15 | H151 | 92.3° | 176.2° |
| H13 | C13 | C15 | H152 | 27.7° | 63.7° |
| H13 | C13 | C15 | H153 | 147.7° | 55.4° |
| H13 | C13 | C17 | H171 | 134.8° | 62.3° |
| H13 | C13 | C17 | H172 | 100.6° | 52.5° |
| H141 | C14 | H142 | H143 | 120.0° | 116.5° |
| H151 | C15 | H152 | H153 | 120.0° | 116.4° |
| O18 | C16 | N19 | C20 | 117.0° | 0.0° |
| O18 | C16 | N19 | H19 | 63.0° | 179.3° |
| C16 | N19 | C20 | H19 | 180.0° | 179.3° |
| C16 | N19 | C20 | C21 | 137.8° | 92.4° |
| C16 | N19 | C20 | C25 | 97.8° | 146.5° |
| C16 | N19 | C20 | H20 | 23.5° | 30.0° |
| N19 | C20 | C21 | C25 | 118.5° | 119.3° |
| N19 | C20 | C21 | H20 | 120.8° | 119.9° |
| N19 | C20 | C25 | H20 | 121.2° | 115.3° |
| N19 | C20 | C21 | C22 | 64.5° | 178.7° |
| N19 | C20 | C21 | H211 | 178.4° | 59.3° |
| N19 | C20 | C21 | H212 | 55.5° | 55.8° |
| N19 | C20 | C25 | N26 | 136.1° | 113.0° |
| N19 | C20 | C25 | O29 | 46.1° | 64.7° |
| H19 | N19 | C20 | C21 | 42.2° | 86.9° |
| H19 | N19 | C20 | C25 | 82.2° | 34.2° |
| H19 | N19 | C20 | H20 | 156.6° | 150.7° |
| C21 | C20 | C25 | H20 | 114.3° | 122.3° |
| C20 | C21 | C22 | H211 | 114.0° | 122.1° |
| C20 | C21 | C22 | H212 | 120.0° | 123.0° |
| C20 | C21 | H211 | H212 | 116.5° | 117.4° |
| C20 | C21 | C22 | C23 | 0.1° | 57.9° |
| C20 | C21 | C22 | C24 | 126.7° | 64.4° |
| C20 | C21 | C22 | H22 | 114.5° | 175.5° |
| C21 | C20 | C25 | N26 | 99.5° | 124.7° |
| C21 | C20 | C25 | O29 | 78.3° | 57.7° |
| C25 | C20 | C21 | C22 | 177.1° | 62.0° |
| C25 | C20 | C21 | H211 | 63.1° | 60.0° |
| C25 | C20 | C21 | H212 | 62.9° | 175.2° |
| C20 | C25 | N26 | O29 | 177.8° | 177.6° |
| C20 | C25 | N26 | C27 | 170.5° | 177.6° |
| C20 | C25 | N26 | H26 | 9.5° | 1.7° |
| H20 | C20 | C21 | C22 | 56.3° | 58.8° |
| H20 | C20 | C21 | H211 | 57.7° | 179.2° |
| H20 | C20 | C21 | H212 | 176.3° | 64.1° |
| H20 | C20 | C25 | N26 | 14.9° | 2.3° |
| H20 | C20 | C25 | O29 | 167.4° | 180.0° |
| C22 | C21 | H211 | H212 | 116.5° | 116.9° |
| C21 | C22 | C23 | C24 | 127.7° | 123.9° |
| C21 | C22 | C23 | H22 | 113.1° | 118.6° |
| C21 | C22 | C24 | H22 | 113.9° | 120.6° |
| C21 | C22 | C23 | H231 | 36.8° | 177.8° |
| C21 | C22 | C23 | H232 | 83.2° | 58.4° |
| C21 | C22 | C23 | H233 | 156.7° | 62.0° |
| C21 | C22 | C24 | H241 | 85.8° | 55.7° |
| C21 | C22 | C24 | H242 | 154.2° | 175.7° |
| C21 | C22 | C24 | H243 | 34.2° | 65.2° |
| H211 | C21 | C22 | C23 | 114.0° | 180.0° |
| H211 | C21 | C22 | C24 | 119.3° | 57.7° |
| H211 | C21 | C22 | H22 | 0.5° | 62.4° |
| H212 | C21 | C22 | C23 | 119.9° | 65.1° |
| H212 | C21 | C22 | C24 | 6.7° | 172.6° |
| H212 | C21 | C22 | H22 | 125.6° | 52.5° |
| C23 | C22 | C24 | H22 | 115.7° | 117.1° |
| C22 | C23 | H231 | H232 | 120.0° | 121.2° |
| C22 | C23 | H231 | H233 | 120.0° | 122.2° |
| C22 | C23 | H232 | H233 | 120.0° | 122.2° |
| C23 | C22 | C24 | H241 | 44.6° | 66.6° |
| C23 | C22 | C24 | H242 | 75.4° | 53.4° |
| C23 | C22 | C24 | H243 | 164.6° | 172.5° |
| C24 | C22 | C23 | H231 | 90.9° | 58.3° |
| C24 | C22 | C23 | H232 | 149.1° | 177.7° |
| C24 | C22 | C23 | H233 | 29.0° | 61.9° |
| C22 | C24 | H241 | H242 | 120.0° | 121.7° |
| C22 | C24 | H241 | H243 | 120.0° | 122.7° |
| C22 | C24 | H242 | H243 | 120.0° | 121.6° |
| H22 | C22 | C23 | H231 | 149.9° | 59.2° |
| H22 | C22 | C23 | H232 | 29.9° | 60.2° |
| H22 | C22 | C23 | H233 | 90.2° | 179.4° |
| H22 | C22 | C24 | H241 | 160.3° | 176.3° |
| H22 | C22 | C24 | H242 | 40.3° | 63.7° |
| H22 | C22 | C24 | H243 | 79.7° | 55.4° |
| H231 | C23 | H232 | H233 | 120.0° | 116.5° |
| H241 | C24 | H242 | H243 | 120.0° | 116.4° |
| C25 | N26 | C27 | H26 | 180.0° | 179.4° |
| C25 | N26 | C27 | C28 | 130.6° | 92.9° |
| C25 | N26 | C27 | C30 | 105.6° | 146.2° |
| C25 | N26 | C27 | H27 | 13.3° | 30.0° |
| O29 | C25 | N26 | C27 | 7.3° | 0.1° |
| O29 | C25 | N26 | H26 | 172.7° | 179.3° |
| N26 | C27 | C28 | C30 | 120.7° | 118.8° |
| N26 | C27 | C28 | H27 | 120.6° | 119.9° |
| N26 | C27 | C30 | H27 | 120.7° | 114.6° |
| N26 | C27 | C28 | C33 | 67.4° | 179.9° |
| N26 | C27 | C28 | H281 | 172.9° | 57.1° |
| N26 | C27 | C28 | H282 | 52.6° | 58.7° |
| N26 | C27 | C30 | O31 | 170.9° | 63.4° |
| N26 | C27 | C30 | C32 | 6.0° | 114.6° |
| H26 | N26 | C27 | C28 | 49.4° | 86.4° |
| H26 | N26 | C27 | C30 | 74.4° | 34.4° |
| H26 | N26 | C27 | H27 | 166.7° | 150.7° |
| C28 | C27 | C30 | H27 | 117.2° | 122.9° |
| C27 | C28 | C33 | H281 | 119.7° | 123.5° |
| C27 | C28 | C33 | H282 | 120.0° | 122.2° |
| C27 | C28 | H281 | H282 | 119.8° | 118.8° |
| C28 | C27 | C30 | O31 | 67.0° | 59.1° |
| C28 | C27 | C30 | C32 | 116.1° | 123.0° |
| C27 | C28 | C33 | C35 | 82.6° | 90.0° |
| C27 | C28 | C33 | C39 | 96.7° | 90.0° |
| C30 | C27 | C28 | C33 | 171.9° | 61.3° |
| C30 | C27 | C28 | H281 | 52.2° | 61.8° |
| C30 | C27 | C28 | H282 | 68.1° | 177.5° |
| C27 | C30 | O31 | C32 | 176.9° | 177.8° |
| C27 | C30 | C32 | F1 | 5.7° | 179.3° |
| C27 | C30 | C32 | H321 | 114.0° | 60.0° |
| C27 | C30 | C32 | H322 | 125.7° | 61.3° |
| H27 | C27 | C28 | C33 | 53.2° | 60.0° |
| H27 | C27 | C28 | H281 | 66.5° | 177.0° |
| H27 | C27 | C28 | H282 | 173.2° | 61.2° |
| H27 | C27 | C30 | O31 | 50.2° | 178.0° |
| H27 | C27 | C30 | C32 | 126.7° | 0.1° |
| C33 | C28 | H281 | H282 | 119.8° | 116.4° |
| C28 | C33 | C35 | C39 | 179.3° | 180.0° |
| C28 | C33 | C35 | C36 | 179.1° | 180.0° |
| C28 | C33 | C35 | H35 | 0.9° | 0.1° |
| C28 | C33 | C39 | C38 | 179.1° | 180.0° |
| C28 | C33 | C39 | H39 | 0.9° | 0.0° |
| H281 | C28 | C33 | C35 | 157.7° | 33.4° |
| H281 | C28 | C33 | C39 | 23.0° | 146.5° |
| H282 | C28 | C33 | C35 | 37.4° | 147.8° |
| H282 | C28 | C33 | C39 | 143.3° | 32.2° |
| O31 | C30 | C32 | F1 | 171.3° | 2.8° |
| O31 | C30 | C32 | H321 | 69.0° | 122.1° |
| O31 | C30 | C32 | H322 | 51.3° | 116.6° |
| C30 | C32 | F1 | H321 | 119.7° | 120.4° |
| C30 | C32 | F1 | H322 | 120.0° | 120.5° |
| C30 | C32 | H321 | H322 | 119.8° | 121.0° |
| F1 | C32 | H321 | H322 | 119.8° | 117.7° |
| C33 | C35 | C36 | H35 | 180.0° | 180.0° |
| C33 | C35 | C36 | C37 | 0.1° | 0.0° |
| C33 | C35 | C36 | H36 | 179.9° | 180.0° |
| C35 | C33 | C39 | C38 | 0.2° | 0.0° |
| C35 | C33 | C39 | H39 | 179.8° | 180.0° |
| C39 | C33 | C35 | C36 | 0.2° | 0.0° |
| C39 | C33 | C35 | H35 | 179.8° | 180.0° |
| C33 | C39 | C38 | C37 | 0.0° | 0.0° |
| C33 | C39 | C38 | H39 | 180.0° | 180.0° |
| C33 | C39 | C38 | H38 | 180.0° | 180.0° |
| C35 | C36 | C37 | H36 | 180.0° | 180.0° |
| C35 | C36 | C37 | C38 | 0.3° | 0.0° |
| C35 | C36 | C37 | O40 | 179.6° | 179.9° |
| H35 | C35 | C36 | C37 | 180.0° | 179.9° |
| H35 | C35 | C36 | H36 | 0.1° | 0.0° |
| C36 | C37 | C38 | O40 | 179.9° | 179.9° |
| C36 | C37 | C38 | C39 | 0.3° | 0.0° |
| C36 | C37 | C38 | H38 | 179.7° | 179.9° |
| C36 | C37 | O40 | H40 | 38.0° | 16.3° |
| H36 | C36 | C37 | C38 | 179.7° | 180.0° |
| H36 | C36 | C37 | O40 | 0.4° | 0.1° |
| C37 | C38 | C39 | H38 | 180.0° | 180.0° |
| C37 | C38 | C39 | H39 | 179.9° | 180.0° |
| C38 | C37 | O40 | H40 | 141.9° | 163.6° |
| O40 | C37 | C38 | C39 | 179.6° | 179.9° |
| O40 | C37 | C38 | H38 | 0.4° | 0.0° |
| H38 | C38 | C39 | H39 | 0.0° | 0.0° |
