664
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.33Å | 1.41Å | Aromatic |
| N1 | C6 | doub | 1.32Å | 1.29Å | Aromatic |
| C2 | N3 | doub | 1.32Å | 1.30Å | Aromatic |
| C2 | N7 | sing | 1.38Å | 1.43Å | |
| N3 | C4 | sing | 1.33Å | 1.42Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.35Å | Aromatic |
| C4 | C26 | sing | 1.48Å | 1.51Å | |
| C5 | C6 | sing | 1.38Å | 1.48Å | Aromatic |
| N7 | C8 | sing | 1.40Å | 1.44Å | |
| C8 | C9 | sing | 1.39Å | 1.37Å | Aromatic |
| C8 | C13 | doub | 1.39Å | 1.49Å | Aromatic |
| C9 | C10 | doub | 1.38Å | 1.51Å | Aromatic |
| C9 | O14 | sing | 1.36Å | 1.44Å | |
| C10 | C11 | sing | 1.38Å | 1.35Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.50Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.36Å | Aromatic |
| C12 | N15 | sing | 1.40Å | 1.42Å | |
| O14 | C22 | sing | 1.43Å | 1.47Å | |
| N15 | C16 | sing | 1.47Å | 1.49Å | |
| N15 | C20 | sing | 1.47Å | 1.48Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | N18 | sing | 1.47Å | 1.48Å | |
| N18 | C19 | sing | 1.47Å | 1.46Å | |
| N18 | C21 | sing | 1.47Å | 1.46Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C22 | F23 | sing | 1.40Å | 1.39Å | |
| C22 | F24 | sing | 1.40Å | 1.40Å | |
| C22 | F25 | sing | 1.40Å | 1.39Å | |
| C26 | N27 | sing | 1.38Å | 1.45Å | Aromatic |
| C26 | C28 | doub | 1.36Å | 1.36Å | Aromatic |
| N27 | C30 | sing | 1.33Å | 1.39Å | Aromatic |
| N27 | C36 | sing | 1.47Å | 1.45Å | |
| C28 | C29 | sing | 1.40Å | 1.47Å | Aromatic |
| C29 | C30 | doub | 1.39Å | 1.33Å | Aromatic |
| C29 | C34 | sing | 1.47Å | 1.47Å | |
| C30 | C31 | sing | 1.51Å | 1.52Å | |
| C31 | C32 | sing | 1.53Å | 1.58Å | |
| C32 | N33 | sing | 1.46Å | 1.48Å | |
| N33 | C34 | sing | 1.35Å | 1.35Å | |
| C34 | O35 | doub | 1.22Å | 1.22Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| N7 | H7 | sing | 0.97Å | 1.00Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | HA | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H213 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C36 | H363 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| N33 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C6 | 120.4° | 121.0° |
| N1 | C2 | N3 | 120.5° | 121.7° |
| N1 | C2 | N7 | 118.2° | 119.1° |
| N1 | C6 | C5 | 120.0° | 119.3° |
| N1 | C6 | H6 | 120.0° | 120.3° |
| N3 | C2 | N7 | 121.3° | 119.1° |
| C2 | N3 | C4 | 122.4° | 120.6° |
| C2 | N7 | C8 | 125.6° | 120.0° |
| C2 | N7 | H7 | 117.2° | 120.0° |
| N3 | C4 | C5 | 117.8° | 118.9° |
| N3 | C4 | C26 | 120.5° | 120.5° |
| C5 | C4 | C26 | 121.7° | 120.6° |
| C4 | C5 | C6 | 118.9° | 118.5° |
| C4 | C5 | H5 | 120.6° | 120.8° |
| C4 | C26 | N27 | 126.7° | 125.8° |
| C4 | C26 | C28 | 124.9° | 125.7° |
| C5 | C6 | H6 | 120.0° | 120.4° |
| C6 | C5 | H5 | 120.5° | 120.7° |
| N7 | C8 | C9 | 119.0° | 120.1° |
| N7 | C8 | C13 | 121.5° | 120.1° |
| C8 | N7 | H7 | 117.2° | 120.0° |
| C9 | C8 | C13 | 119.5° | 119.9° |
| C8 | C9 | C10 | 119.5° | 120.0° |
| C8 | C9 | O14 | 117.9° | 120.0° |
| C8 | C13 | C12 | 121.0° | 120.0° |
| C8 | C13 | H13 | 119.5° | 120.0° |
| C10 | C9 | O14 | 122.5° | 120.0° |
| C9 | C10 | C11 | 120.3° | 120.1° |
| C9 | C10 | H10 | 119.9° | 119.9° |
| C9 | O14 | C22 | 117.1° | 117.1° |
| C10 | C11 | C12 | 120.4° | 120.1° |
| C11 | C10 | H10 | 119.9° | 119.9° |
| C10 | C11 | HA | 119.8° | 120.0° |
| C11 | C12 | C13 | 119.4° | 120.0° |
| C11 | C12 | N15 | 119.9° | 120.0° |
| C12 | C11 | HA | 119.8° | 119.9° |
| C13 | C12 | N15 | 120.7° | 120.0° |
| C12 | C13 | H13 | 119.5° | 120.0° |
| C12 | N15 | C16 | 119.0° | 111.0° |
| C12 | N15 | C20 | 118.6° | 111.0° |
| O14 | C22 | F23 | 110.8° | 109.4° |
| O14 | C22 | F24 | 110.6° | 109.5° |
| O14 | C22 | F25 | 108.5° | 109.5° |
| C16 | N15 | C20 | 122.4° | 110.9° |
| N15 | C16 | C17 | 112.8° | 109.3° |
| N15 | C16 | H161 | 108.7° | 109.5° |
| N15 | C16 | H162 | 108.6° | 109.5° |
| N15 | C20 | C19 | 112.1° | 109.4° |
| N15 | C20 | H201 | 108.8° | 109.5° |
| N15 | C20 | H202 | 108.8° | 109.5° |
| C16 | C17 | N18 | 109.3° | 109.4° |
| C17 | C16 | H161 | 108.6° | 109.5° |
| C17 | C16 | H162 | 108.6° | 109.5° |
| C16 | C17 | H171 | 109.5° | 109.4° |
| C16 | C17 | H172 | 109.5° | 109.5° |
| C17 | N18 | C19 | 108.4° | 110.8° |
| C17 | N18 | C21 | 109.7° | 111.0° |
| N18 | C17 | H171 | 109.5° | 109.5° |
| N18 | C17 | H172 | 109.5° | 109.5° |
| C19 | N18 | C21 | 108.8° | 111.0° |
| N18 | C19 | C20 | 109.5° | 109.4° |
| N18 | C19 | H191 | 109.4° | 109.5° |
| N18 | C19 | H192 | 109.4° | 109.5° |
| N18 | C21 | H211 | 109.5° | 109.5° |
| N18 | C21 | H212 | 109.4° | 109.5° |
| N18 | C21 | H213 | 109.5° | 109.5° |
| C19 | C20 | H201 | 108.8° | 109.4° |
| C19 | C20 | H202 | 108.8° | 109.5° |
| C20 | C19 | H191 | 109.4° | 109.5° |
| C20 | C19 | H192 | 109.4° | 109.5° |
| F23 | C22 | F24 | 109.8° | 109.5° |
| F23 | C22 | F25 | 108.5° | 109.4° |
| F24 | C22 | F25 | 108.6° | 109.5° |
| N27 | C26 | C28 | 108.4° | 108.6° |
| C26 | N27 | C30 | 107.7° | 109.1° |
| C26 | N27 | C36 | 127.9° | 125.4° |
| C26 | C28 | C29 | 105.7° | 106.7° |
| C26 | C28 | H28 | 127.2° | 126.7° |
| C30 | N27 | C36 | 124.4° | 125.5° |
| N27 | C30 | C29 | 108.4° | 108.1° |
| N27 | C30 | C31 | 127.4° | 130.9° |
| N27 | C36 | H361 | 109.5° | 109.4° |
| N27 | C36 | H362 | 109.5° | 109.4° |
| N27 | C36 | H363 | 109.5° | 109.5° |
| C28 | C29 | C30 | 109.9° | 107.5° |
| C28 | C29 | C34 | 128.4° | 131.8° |
| C29 | C28 | H28 | 127.2° | 126.6° |
| C30 | C29 | C34 | 121.8° | 120.7° |
| C29 | C30 | C31 | 124.2° | 121.0° |
| C29 | C34 | N33 | 119.0° | 116.7° |
| C29 | C34 | O35 | 121.2° | 121.7° |
| C30 | C31 | C32 | 112.1° | 108.8° |
| C30 | C31 | H311 | 108.8° | 109.6° |
| C30 | C31 | H312 | 108.8° | 109.6° |
| C31 | C32 | N33 | 115.0° | 112.9° |
| C32 | C31 | H311 | 108.8° | 109.5° |
| C32 | C31 | H312 | 108.8° | 109.6° |
| C31 | C32 | H321 | 108.1° | 108.8° |
| C31 | C32 | H322 | 108.1° | 108.8° |
| C32 | N33 | C34 | 121.8° | 122.6° |
| N33 | C32 | H321 | 108.1° | 108.8° |
| N33 | C32 | H322 | 108.1° | 108.8° |
| C32 | N33 | H33 | 119.1° | 118.7° |
| N33 | C34 | O35 | 119.8° | 121.6° |
| C34 | N33 | H33 | 119.1° | 118.7° |
| H161 | C16 | H162 | 109.4° | 109.5° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| H211 | C21 | H213 | 109.5° | 109.4° |
| H212 | C21 | H213 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.5° |
| H361 | C36 | H363 | 109.4° | 109.5° |
| H362 | C36 | H363 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.5° | 109.7° |
| H321 | C32 | H322 | 109.5° | 108.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C2 | N3 | N7 | 179.8° | 179.9° |
| N1 | C2 | N3 | C4 | 0.0° | 0.1° |
| C2 | N1 | C6 | C5 | 0.2° | 0.1° |
| N1 | C2 | N7 | C8 | 177.9° | 5.7° |
| C2 | N1 | C6 | H6 | 179.8° | 179.9° |
| N1 | C2 | N7 | H7 | 2.1° | 174.4° |
| C6 | N1 | C2 | N3 | 0.1° | 0.1° |
| C6 | N1 | C2 | N7 | 179.8° | 180.0° |
| N1 | C6 | C5 | C4 | 0.2° | 0.0° |
| N1 | C6 | C5 | H6 | 180.0° | 180.0° |
| N1 | C6 | C5 | H5 | 179.7° | 180.0° |
| C2 | N3 | C4 | C5 | 0.1° | 0.0° |
| C2 | N3 | C4 | C26 | 179.5° | 180.0° |
| N3 | C2 | N7 | C8 | 2.4° | 174.4° |
| N3 | C2 | N7 | H7 | 177.6° | 5.5° |
| N7 | C2 | N3 | C4 | 179.8° | 179.9° |
| C2 | N7 | C8 | H7 | 180.0° | 179.9° |
| C2 | N7 | C8 | C9 | 135.6° | 147.6° |
| C2 | N7 | C8 | C13 | 44.6° | 32.1° |
| N3 | C4 | C5 | C26 | 179.4° | 180.0° |
| N3 | C4 | C5 | C6 | 0.2° | 0.0° |
| N3 | C4 | C26 | N27 | 17.2° | 5.2° |
| N3 | C4 | C26 | C28 | 162.1° | 175.1° |
| N3 | C4 | C5 | H5 | 179.8° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C5 | C4 | C26 | N27 | 163.4° | 174.8° |
| C5 | C4 | C26 | C28 | 17.3° | 4.9° |
| C4 | C5 | C6 | H6 | 179.8° | 180.0° |
| C26 | C4 | C5 | C6 | 179.6° | 180.0° |
| C4 | C26 | N27 | C28 | 179.3° | 179.7° |
| C4 | C26 | N27 | C30 | 179.1° | 179.9° |
| C4 | C26 | N27 | C36 | 0.4° | 0.2° |
| C4 | C26 | C28 | C29 | 179.1° | 180.0° |
| C26 | C4 | C5 | H5 | 0.4° | 0.0° |
| C4 | C26 | C28 | H28 | 0.9° | 0.1° |
| N7 | C8 | C9 | C13 | 179.8° | 179.7° |
| N7 | C8 | C9 | C10 | 180.0° | 180.0° |
| N7 | C8 | C9 | O14 | 0.3° | 0.0° |
| N7 | C8 | C13 | C12 | 179.7° | 180.0° |
| N7 | C8 | C13 | H13 | 0.3° | 0.0° |
| C8 | C9 | C10 | O14 | 179.6° | 180.0° |
| C8 | C9 | C10 | C11 | 0.2° | 0.0° |
| C9 | C8 | C13 | C12 | 0.1° | 0.3° |
| C8 | C9 | O14 | C22 | 113.4° | 180.0° |
| C9 | C8 | N7 | H7 | 44.4° | 32.5° |
| C9 | C8 | C13 | H13 | 179.9° | 179.8° |
| C8 | C9 | C10 | H10 | 179.9° | 179.8° |
| C13 | C8 | C9 | C10 | 0.1° | 0.3° |
| C13 | C8 | C9 | O14 | 179.5° | 179.8° |
| C8 | C13 | C12 | C11 | 0.3° | 0.0° |
| C8 | C13 | C12 | H13 | 180.0° | 180.0° |
| C8 | C13 | C12 | N15 | 179.4° | 179.7° |
| C13 | C8 | N7 | H7 | 135.4° | 147.8° |
| C9 | C10 | C11 | H10 | 180.0° | 179.8° |
| C9 | C10 | C11 | C12 | 0.0° | 0.3° |
| C10 | C9 | O14 | C22 | 66.2° | 0.1° |
| C9 | C10 | C11 | HA | 180.0° | 179.8° |
| O14 | C9 | C10 | C11 | 179.5° | 180.0° |
| C9 | O14 | C22 | F23 | 76.8° | 60.0° |
| C9 | O14 | C22 | F24 | 45.2° | 180.0° |
| C9 | O14 | C22 | F25 | 164.2° | 59.9° |
| O14 | C9 | C10 | H10 | 0.5° | 0.2° |
| C10 | C11 | C12 | HA | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 0.2° | 0.3° |
| C10 | C11 | C12 | N15 | 179.4° | 180.0° |
| C11 | C12 | C13 | N15 | 179.7° | 179.7° |
| C11 | C12 | N15 | C16 | 150.9° | 0.0° |
| C11 | C12 | N15 | C20 | 27.8° | 123.8° |
| C11 | C12 | C13 | H13 | 179.7° | 179.9° |
| C12 | C11 | C10 | H10 | 180.0° | 179.9° |
| C13 | C12 | N15 | C16 | 28.8° | 179.7° |
| C13 | C12 | N15 | C20 | 152.6° | 55.9° |
| C13 | C12 | C11 | HA | 179.8° | 179.7° |
| C12 | N15 | C16 | C20 | 178.6° | 123.9° |
| C12 | N15 | C16 | C17 | 158.0° | 176.8° |
| C12 | N15 | C20 | C19 | 156.3° | 176.8° |
| N15 | C12 | C13 | H13 | 0.6° | 0.3° |
| N15 | C12 | C11 | HA | 0.6° | 0.1° |
| C12 | N15 | C16 | H161 | 81.6° | 63.2° |
| C12 | N15 | C16 | H162 | 37.4° | 56.9° |
| C12 | N15 | C20 | H201 | 35.9° | 56.9° |
| C12 | N15 | C20 | H202 | 83.3° | 63.2° |
| O14 | C22 | F23 | F24 | 122.5° | 120.0° |
| O14 | C22 | F23 | F25 | 118.9° | 119.9° |
| O14 | C22 | F24 | F25 | 118.9° | 120.0° |
| N15 | C16 | C17 | H161 | 120.5° | 120.0° |
| N15 | C16 | C17 | H162 | 120.5° | 119.9° |
| N15 | C16 | C17 | N18 | 42.6° | 58.5° |
| C16 | N15 | C20 | C19 | 25.1° | 59.3° |
| N15 | C16 | H161 | H162 | 118.5° | 120.1° |
| C16 | N15 | C20 | H201 | 145.5° | 179.3° |
| C16 | N15 | C20 | H202 | 95.3° | 60.6° |
| N15 | C16 | C17 | H171 | 162.6° | 178.4° |
| N15 | C16 | C17 | H172 | 77.3° | 61.6° |
| C20 | N15 | C16 | C17 | 23.5° | 59.3° |
| N15 | C20 | C19 | N18 | 46.6° | 58.4° |
| N15 | C20 | C19 | H201 | 120.4° | 120.0° |
| N15 | C20 | C19 | H202 | 120.4° | 120.0° |
| C20 | N15 | C16 | H161 | 97.0° | 60.7° |
| C20 | N15 | C16 | H162 | 144.0° | 179.3° |
| N15 | C20 | H201 | H202 | 118.8° | 120.1° |
| N15 | C20 | C19 | H191 | 166.6° | 178.3° |
| N15 | C20 | C19 | H192 | 73.4° | 61.6° |
| C16 | C17 | N18 | H171 | 120.0° | 119.9° |
| C16 | C17 | N18 | H172 | 120.0° | 120.0° |
| C16 | C17 | N18 | C19 | 67.7° | 59.4° |
| C16 | C17 | N18 | C21 | 173.7° | 176.8° |
| C17 | C16 | H161 | H162 | 118.5° | 120.0° |
| C16 | C17 | H171 | H172 | 120.1° | 120.0° |
| C17 | N18 | C19 | C21 | 119.2° | 123.8° |
| C17 | N18 | C19 | C20 | 70.1° | 59.3° |
| N18 | C17 | C16 | H161 | 77.9° | 61.6° |
| N18 | C17 | C16 | H162 | 163.2° | 178.4° |
| N18 | C17 | H171 | H172 | 120.0° | 120.1° |
| C17 | N18 | C19 | H191 | 169.9° | 179.3° |
| C17 | N18 | C19 | H192 | 49.9° | 60.7° |
| C17 | N18 | C21 | H211 | 180.0° | 60.0° |
| C17 | N18 | C21 | H212 | 60.0° | 180.0° |
| C17 | N18 | C21 | H213 | 60.0° | 60.0° |
| N18 | C19 | C20 | H191 | 120.0° | 119.9° |
| N18 | C19 | C20 | H192 | 120.0° | 120.0° |
| N18 | C19 | C20 | H201 | 167.0° | 178.4° |
| N18 | C19 | C20 | H202 | 73.8° | 61.6° |
| C19 | N18 | C17 | H171 | 172.4° | 179.3° |
| C19 | N18 | C17 | H172 | 52.3° | 60.7° |
| N18 | C19 | H191 | H192 | 120.0° | 120.1° |
| C19 | N18 | C21 | H211 | 61.6° | 63.7° |
| C19 | N18 | C21 | H212 | 178.4° | 56.2° |
| C19 | N18 | C21 | H213 | 58.4° | 176.3° |
| C21 | N18 | C19 | C20 | 170.7° | 176.8° |
| C21 | N18 | C17 | H171 | 53.7° | 56.9° |
| C21 | N18 | C17 | H172 | 66.3° | 63.2° |
| C21 | N18 | C19 | H191 | 50.7° | 56.9° |
| C21 | N18 | C19 | H192 | 69.3° | 63.2° |
| N18 | C21 | H211 | H212 | 120.0° | 120.0° |
| N18 | C21 | H211 | H213 | 120.0° | 120.0° |
| N18 | C21 | H212 | H213 | 120.0° | 120.1° |
| C19 | C20 | H201 | H202 | 118.8° | 120.0° |
| C20 | C19 | H191 | H192 | 120.0° | 120.1° |
| F23 | C22 | F24 | F25 | 118.5° | 120.0° |
| C26 | N27 | C30 | C36 | 179.6° | 180.0° |
| N27 | C26 | C28 | C29 | 0.2° | 0.2° |
| C26 | N27 | C30 | C29 | 0.1° | 0.0° |
| C26 | N27 | C30 | C31 | 179.6° | 179.8° |
| N27 | C26 | C28 | H28 | 179.8° | 179.7° |
| C26 | N27 | C36 | H361 | 180.0° | 81.8° |
| C26 | N27 | C36 | H362 | 60.0° | 158.2° |
| C26 | N27 | C36 | H363 | 60.0° | 38.2° |
| C28 | C26 | N27 | C30 | 0.2° | 0.1° |
| C28 | C26 | N27 | C36 | 179.7° | 179.9° |
| C26 | C28 | C29 | H28 | 180.0° | 179.9° |
| C26 | C28 | C29 | C30 | 0.2° | 0.2° |
| C26 | C28 | C29 | C34 | 179.3° | 179.8° |
| N27 | C30 | C29 | C28 | 0.0° | 0.2° |
| N27 | C30 | C29 | C31 | 179.7° | 179.8° |
| N27 | C30 | C29 | C34 | 179.4° | 179.9° |
| N27 | C30 | C31 | C32 | 171.2° | 150.9° |
| C30 | N27 | C36 | H361 | 0.5° | 98.2° |
| C30 | N27 | C36 | H362 | 120.5° | 21.8° |
| C30 | N27 | C36 | H363 | 119.5° | 141.8° |
| N27 | C30 | C31 | H311 | 68.4° | 89.4° |
| N27 | C30 | C31 | H312 | 50.8° | 31.1° |
| C36 | N27 | C30 | C29 | 179.7° | 180.0° |
| C36 | N27 | C30 | C31 | 0.0° | 0.3° |
| N27 | C36 | H361 | H362 | 120.0° | 120.0° |
| N27 | C36 | H361 | H363 | 120.0° | 120.0° |
| N27 | C36 | H362 | H363 | 120.0° | 120.0° |
| C28 | C29 | C30 | C34 | 179.5° | 180.0° |
| C28 | C29 | C30 | C31 | 179.7° | 179.6° |
| C28 | C29 | C34 | N33 | 174.1° | 167.4° |
| C28 | C29 | C34 | O35 | 6.5° | 12.7° |
| C29 | C30 | C31 | C32 | 8.4° | 28.8° |
| C30 | C29 | C34 | N33 | 6.5° | 12.6° |
| C30 | C29 | C34 | O35 | 172.8° | 167.3° |
| C30 | C29 | C28 | H28 | 179.8° | 179.7° |
| C29 | C30 | C31 | H311 | 112.0° | 90.9° |
| C29 | C30 | C31 | H312 | 128.8° | 148.7° |
| C34 | C29 | C30 | C31 | 0.3° | 0.3° |
| C29 | C34 | N33 | C32 | 22.5° | 8.4° |
| C29 | C34 | N33 | O35 | 179.4° | 179.9° |
| C34 | C29 | C28 | H28 | 0.7° | 0.3° |
| C29 | C34 | N33 | H33 | 157.5° | 171.9° |
| C30 | C31 | C32 | H311 | 120.4° | 119.7° |
| C30 | C31 | C32 | H312 | 120.4° | 119.8° |
| C30 | C31 | C32 | N33 | 21.7° | 46.4° |
| C30 | C31 | H311 | H312 | 118.8° | 120.4° |
| C30 | C31 | C32 | H321 | 142.5° | 167.4° |
| C30 | C31 | C32 | H322 | 99.1° | 74.4° |
| C31 | C32 | N33 | H321 | 120.8° | 120.9° |
| C31 | C32 | N33 | H322 | 120.8° | 120.8° |
| C31 | C32 | N33 | C34 | 30.3° | 39.4° |
| C32 | C31 | H311 | H312 | 118.8° | 120.4° |
| C31 | C32 | H321 | H322 | 117.5° | 118.3° |
| C31 | C32 | N33 | H33 | 149.7° | 140.9° |
| C32 | N33 | C34 | H33 | 180.0° | 179.7° |
| C32 | N33 | C34 | O35 | 156.9° | 171.6° |
| N33 | C32 | C31 | H311 | 98.7° | 73.3° |
| N33 | C32 | C31 | H312 | 142.1° | 166.3° |
| N33 | C32 | H321 | H322 | 117.5° | 118.3° |
| C34 | N33 | C32 | H321 | 151.1° | 160.3° |
| C34 | N33 | C32 | H322 | 90.5° | 81.5° |
| O35 | C34 | N33 | H33 | 23.1° | 8.1° |
| H6 | C6 | C5 | H5 | 0.2° | 0.0° |
| H10 | C10 | C11 | HA | 0.0° | 0.0° |
| H161 | C16 | C17 | H171 | 42.1° | 58.4° |
| H161 | C16 | C17 | H172 | 162.2° | 178.4° |
| H162 | C16 | C17 | H171 | 76.9° | 61.7° |
| H162 | C16 | C17 | H172 | 43.2° | 58.3° |
| H201 | C20 | C19 | H191 | 73.0° | 61.7° |
| H201 | C20 | C19 | H192 | 47.0° | 58.4° |
| H202 | C20 | C19 | H191 | 46.2° | 58.3° |
| H202 | C20 | C19 | H192 | 166.3° | 178.4° |
| H211 | C21 | H212 | H213 | 120.0° | 119.9° |
| H361 | C36 | H362 | H363 | 120.0° | 120.1° |
| H311 | C31 | C32 | H321 | 22.1° | 47.6° |
| H311 | C31 | C32 | H322 | 140.5° | 165.8° |
| H312 | C31 | C32 | H321 | 97.1° | 72.8° |
| H312 | C31 | C32 | H322 | 21.3° | 45.4° |
| H321 | C32 | N33 | H33 | 28.9° | 20.0° |
| H322 | C32 | N33 | H33 | 89.5° | 98.2° |
