A1A2C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | O01 | doub | 1.22Å | 1.18Å | |
| C04 | N03 | sing | 1.46Å | 1.46Å | |
| C05 | N03 | sing | 1.40Å | 1.47Å | |
| C06 | C05 | doub | 1.39Å | 1.40Å | Aromatic |
| C07 | C06 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | C07 | doub | 1.39Å | 1.39Å | Aromatic |
| F09 | C08 | sing | 1.35Å | 1.37Å | |
| C10 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| N03 | C02 | sing | 1.35Å | 1.48Å | |
| O12 | C02 | sing | 1.35Å | 1.43Å | |
| C13 | O12 | sing | 1.36Å | 1.44Å | |
| C14 | C13 | doub | 1.39Å | 1.41Å | Aromatic |
| C16 | N15 | sing | 1.47Å | 1.44Å | |
| C17 | C16 | sing | 1.54Å | 1.50Å | |
| N18 | C17 | sing | 1.47Å | 1.45Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| O21 | C20 | sing | 1.43Å | 1.37Å | |
| C22 | C20 | sing | 1.53Å | 1.56Å | |
| N23 | C22 | sing | 1.47Å | 1.48Å | |
| C24 | N23 | sing | 1.47Å | 1.46Å | |
| C25 | N23 | sing | 1.47Å | 1.47Å | |
| C19 | N18 | sing | 1.46Å | 1.49Å | |
| C26 | N18 | sing | 1.34Å | 1.48Å | |
| O27 | C26 | doub | 1.22Å | 1.18Å | |
| N15 | C14 | sing | 1.40Å | 1.47Å | |
| C28 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| F31 | C30 | sing | 1.40Å | 1.37Å | |
| F32 | C30 | sing | 1.40Å | 1.36Å | |
| F33 | C30 | sing | 1.40Å | 1.36Å | |
| C30 | C29 | sing | 1.51Å | 1.54Å | |
| C34 | C29 | sing | 1.38Å | 1.41Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C36 | C35 | sing | 1.51Å | 1.53Å | |
| F37 | C36 | sing | 1.40Å | 1.36Å | |
| F38 | C36 | sing | 1.40Å | 1.36Å | |
| F39 | C36 | sing | 1.40Å | 1.36Å | |
| C05 | C11 | sing | 1.39Å | 1.38Å | Aromatic |
| C13 | C35 | sing | 1.39Å | 1.40Å | Aromatic |
| N15 | C26 | sing | 1.34Å | 1.48Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C04 | H043 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| 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 | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| O21 | H211 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | N03 | 121.6° | 120.0° |
| O01 | C02 | O12 | 121.0° | 120.0° |
| C04 | N03 | C05 | 122.1° | 120.0° |
| C04 | N03 | C02 | 122.3° | 120.0° |
| N03 | C04 | H043 | 109.5° | 109.5° |
| N03 | C04 | H041 | 109.5° | 109.5° |
| N03 | C04 | H042 | 109.4° | 109.5° |
| N03 | C05 | C06 | 119.9° | 120.1° |
| C05 | N03 | C02 | 115.6° | 120.0° |
| N03 | C05 | C11 | 119.2° | 120.0° |
| C05 | C06 | C07 | 119.4° | 120.0° |
| C06 | C05 | C11 | 120.9° | 119.9° |
| C05 | C06 | H061 | 120.3° | 120.0° |
| C06 | C07 | C08 | 119.8° | 120.0° |
| C07 | C06 | H061 | 120.3° | 120.0° |
| C06 | C07 | H071 | 120.1° | 120.0° |
| C07 | C08 | F09 | 119.9° | 119.9° |
| C07 | C08 | C10 | 120.6° | 120.1° |
| C08 | C07 | H071 | 120.1° | 120.0° |
| F09 | C08 | C10 | 119.5° | 120.0° |
| C08 | C10 | C11 | 119.7° | 120.1° |
| C08 | C10 | H101 | 120.2° | 120.0° |
| C10 | C11 | C05 | 119.6° | 120.0° |
| C11 | C10 | H101 | 120.1° | 120.0° |
| C10 | C11 | H111 | 120.2° | 120.0° |
| N03 | C02 | O12 | 117.4° | 120.0° |
| C02 | O12 | C13 | 113.7° | 117.0° |
| O12 | C13 | C14 | 119.8° | 120.1° |
| O12 | C13 | C35 | 119.1° | 120.1° |
| C13 | C14 | N15 | 119.3° | 120.1° |
| C13 | C14 | C28 | 119.3° | 119.8° |
| C14 | C13 | C35 | 121.1° | 119.9° |
| N15 | C16 | C17 | 108.6° | 103.9° |
| C16 | N15 | C14 | 124.8° | 125.4° |
| C16 | N15 | C26 | 107.6° | 109.2° |
| N15 | C16 | H161 | 109.7° | 110.5° |
| N15 | C16 | H162 | 109.7° | 110.6° |
| C16 | C17 | N18 | 107.3° | 103.9° |
| C17 | C16 | H161 | 109.7° | 110.6° |
| C17 | C16 | H162 | 109.7° | 110.7° |
| C16 | C17 | H171 | 110.0° | 110.5° |
| C16 | C17 | H172 | 110.0° | 110.6° |
| C17 | N18 | C19 | 125.6° | 125.4° |
| C17 | N18 | C26 | 108.4° | 109.2° |
| N18 | C17 | H171 | 110.0° | 110.6° |
| N18 | C17 | H172 | 110.0° | 110.7° |
| C19 | C20 | O21 | 109.0° | 109.5° |
| C19 | C20 | C22 | 108.5° | 109.5° |
| C20 | C19 | N18 | 109.9° | 109.4° |
| C19 | C20 | H201 | 108.9° | 109.5° |
| C20 | C19 | H191 | 109.4° | 109.4° |
| C20 | C19 | H192 | 109.4° | 109.5° |
| O21 | C20 | C22 | 110.3° | 109.5° |
| O21 | C20 | H201 | 111.4° | 109.4° |
| C20 | O21 | H211 | 109.5° | 114.0° |
| C20 | C22 | N23 | 114.4° | 109.5° |
| C22 | C20 | H201 | 108.6° | 109.4° |
| C20 | C22 | H222 | 108.2° | 109.5° |
| C20 | C22 | H221 | 108.2° | 109.4° |
| C22 | N23 | C24 | 111.6° | 111.0° |
| C22 | N23 | C25 | 111.8° | 111.0° |
| N23 | C22 | H222 | 108.2° | 109.4° |
| N23 | C22 | H221 | 108.2° | 109.5° |
| C24 | N23 | C25 | 111.0° | 111.0° |
| N23 | C24 | H243 | 109.5° | 109.5° |
| N23 | C24 | H241 | 109.5° | 109.5° |
| N23 | C24 | H242 | 109.5° | 109.5° |
| N23 | C25 | H251 | 109.5° | 109.5° |
| N23 | C25 | H253 | 109.5° | 109.5° |
| N23 | C25 | H252 | 109.5° | 109.5° |
| C19 | N18 | C26 | 126.0° | 125.4° |
| N18 | C19 | H191 | 109.3° | 109.5° |
| N18 | C19 | H192 | 109.4° | 109.5° |
| N18 | C26 | O27 | 125.5° | 123.1° |
| N18 | C26 | N15 | 108.1° | 113.9° |
| O27 | C26 | N15 | 126.4° | 123.0° |
| N15 | C14 | C28 | 121.4° | 120.1° |
| C14 | N15 | C26 | 127.6° | 125.4° |
| C14 | C28 | C29 | 119.6° | 120.0° |
| C14 | C28 | H281 | 120.2° | 120.0° |
| C28 | C29 | C30 | 120.0° | 119.9° |
| C28 | C29 | C34 | 120.9° | 120.2° |
| C29 | C28 | H281 | 120.2° | 120.0° |
| F31 | C30 | F32 | 109.3° | 109.5° |
| F31 | C30 | F33 | 109.8° | 109.5° |
| F31 | C30 | C29 | 108.9° | 109.5° |
| F32 | C30 | F33 | 109.8° | 109.5° |
| F32 | C30 | C29 | 109.8° | 109.5° |
| F33 | C30 | C29 | 109.1° | 109.4° |
| C30 | C29 | C34 | 119.1° | 119.9° |
| C29 | C34 | C35 | 119.7° | 120.2° |
| C29 | C34 | H341 | 120.2° | 120.0° |
| C34 | C35 | C36 | 120.7° | 120.0° |
| C34 | C35 | C13 | 119.4° | 120.0° |
| C35 | C34 | H341 | 120.2° | 119.9° |
| C35 | C36 | F37 | 110.2° | 109.4° |
| C35 | C36 | F38 | 110.0° | 109.5° |
| C35 | C36 | F39 | 109.3° | 109.5° |
| C36 | C35 | C13 | 119.9° | 120.0° |
| F37 | C36 | F38 | 109.1° | 109.5° |
| F37 | C36 | F39 | 109.1° | 109.4° |
| F38 | C36 | F39 | 109.1° | 109.5° |
| C05 | C11 | H111 | 120.2° | 120.0° |
| H243 | C24 | H241 | 109.4° | 109.5° |
| H243 | C24 | H242 | 109.5° | 109.4° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H043 | C04 | H041 | 109.4° | 109.5° |
| H043 | C04 | H042 | 109.5° | 109.5° |
| H041 | C04 | H042 | 109.5° | 109.4° |
| H161 | C16 | H162 | 109.5° | 110.5° |
| H171 | C17 | H172 | 109.5° | 110.5° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H222 | C22 | H221 | 109.5° | 109.5° |
| H251 | C25 | H253 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.4° |
| H253 | C25 | H252 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | N03 | C04 | 7.0° | 175.1° |
| O01 | C02 | N03 | C05 | 173.0° | 4.8° |
| O01 | C02 | N03 | O12 | 179.9° | 180.0° |
| O01 | C02 | O12 | C13 | 10.2° | 0.0° |
| C04 | N03 | C05 | C02 | 179.9° | 180.0° |
| C04 | N03 | C05 | C06 | 81.6° | 67.3° |
| C04 | N03 | C02 | O12 | 173.1° | 4.9° |
| C04 | N03 | C05 | C11 | 100.1° | 112.4° |
| N03 | C04 | H043 | H041 | 120.0° | 120.0° |
| N03 | C04 | H043 | H042 | 120.0° | 120.1° |
| N03 | C04 | H041 | H042 | 120.0° | 120.0° |
| N03 | C05 | C06 | C11 | 178.2° | 179.7° |
| N03 | C05 | C06 | C07 | 179.2° | 179.9° |
| N03 | C05 | C11 | C10 | 179.3° | 179.7° |
| C05 | N03 | C02 | O12 | 6.8° | 175.2° |
| C05 | N03 | C04 | H043 | 180.0° | 90.0° |
| C05 | N03 | C04 | H041 | 60.0° | 150.0° |
| C05 | N03 | C04 | H042 | 60.0° | 30.1° |
| N03 | C05 | C06 | H061 | 0.8° | 0.0° |
| N03 | C05 | C11 | H111 | 0.8° | 0.0° |
| C05 | C06 | C07 | H061 | 180.0° | 180.0° |
| C05 | C06 | C07 | C08 | 0.5° | 0.1° |
| C06 | C05 | C11 | C10 | 1.0° | 0.5° |
| C06 | C05 | N03 | C02 | 98.3° | 112.6° |
| C05 | C06 | C07 | H071 | 179.5° | 180.0° |
| C06 | C05 | C11 | H111 | 179.0° | 179.8° |
| C06 | C07 | C08 | H071 | 180.0° | 179.9° |
| C06 | C07 | C08 | F09 | 180.0° | 179.9° |
| C06 | C07 | C08 | C10 | 0.0° | 0.0° |
| C07 | C06 | C05 | C11 | 1.0° | 0.2° |
| C07 | C08 | F09 | C10 | 180.0° | 180.0° |
| C07 | C08 | C10 | C11 | 0.0° | 0.3° |
| C08 | C07 | C06 | H061 | 179.5° | 179.9° |
| C07 | C08 | C10 | H101 | 180.0° | 179.9° |
| F09 | C08 | C10 | C11 | 180.0° | 179.7° |
| F09 | C08 | C07 | H071 | 0.0° | 0.0° |
| F09 | C08 | C10 | H101 | 0.0° | 0.1° |
| C08 | C10 | C11 | H101 | 180.0° | 179.8° |
| C08 | C10 | C11 | C05 | 0.5° | 0.6° |
| C10 | C08 | C07 | H071 | 180.0° | 180.0° |
| C08 | C10 | C11 | H111 | 179.5° | 179.7° |
| C10 | C11 | C05 | H111 | 180.0° | 179.7° |
| N03 | C02 | O12 | C13 | 169.9° | 180.0° |
| C02 | N03 | C05 | C11 | 79.9° | 67.7° |
| C02 | N03 | C04 | H043 | 0.1° | 90.0° |
| C02 | N03 | C04 | H041 | 119.9° | 30.0° |
| C02 | N03 | C04 | H042 | 120.1° | 150.0° |
| C02 | O12 | C13 | C14 | 77.2° | 90.0° |
| C02 | O12 | C13 | C35 | 102.3° | 90.0° |
| O12 | C13 | C14 | C35 | 179.5° | 180.0° |
| O12 | C13 | C14 | N15 | 0.5° | 0.1° |
| O12 | C13 | C14 | C28 | 179.9° | 180.0° |
| O12 | C13 | C35 | C34 | 179.8° | 180.0° |
| O12 | C13 | C35 | C36 | 0.5° | 0.3° |
| C13 | C14 | N15 | C16 | 57.5° | 90.0° |
| C13 | C14 | N15 | C28 | 179.6° | 179.9° |
| C13 | C14 | C28 | C29 | 0.4° | 0.1° |
| C14 | C13 | C35 | C34 | 0.3° | 0.0° |
| C14 | C13 | C35 | C36 | 179.9° | 179.7° |
| C13 | C14 | N15 | C26 | 121.9° | 90.0° |
| C13 | C14 | C28 | H281 | 179.6° | 180.0° |
| N15 | C16 | C17 | H161 | 119.9° | 118.6° |
| N15 | C16 | C17 | H162 | 119.9° | 118.7° |
| N15 | C16 | C17 | N18 | 0.1° | 0.0° |
| C16 | N15 | C26 | N18 | 0.0° | 0.0° |
| C16 | N15 | C26 | O27 | 180.0° | 179.7° |
| C16 | N15 | C14 | C26 | 179.4° | 180.0° |
| C16 | N15 | C14 | C28 | 122.0° | 89.9° |
| N15 | C16 | H161 | H162 | 120.4° | 122.7° |
| N15 | C16 | C17 | H171 | 119.7° | 118.6° |
| N15 | C16 | C17 | H172 | 119.6° | 118.7° |
| C16 | C17 | N18 | H171 | 119.7° | 118.6° |
| C16 | C17 | N18 | H172 | 119.6° | 118.7° |
| C16 | C17 | N18 | C19 | 179.8° | 180.0° |
| C16 | C17 | N18 | C26 | 0.0° | 0.0° |
| C17 | C16 | N15 | C14 | 179.6° | 180.0° |
| C17 | C16 | N15 | C26 | 0.1° | 0.0° |
| C17 | C16 | H161 | H162 | 120.4° | 122.9° |
| C16 | C17 | H171 | H172 | 121.0° | 122.7° |
| C17 | N18 | C19 | C20 | 97.3° | 90.0° |
| C17 | N18 | C19 | C26 | 179.7° | 180.0° |
| C17 | N18 | C26 | O27 | 180.0° | 179.7° |
| C17 | N18 | C26 | N15 | 0.0° | 0.0° |
| N18 | C17 | C16 | H161 | 119.8° | 118.6° |
| N18 | C17 | C16 | H162 | 119.9° | 118.7° |
| N18 | C17 | H171 | H172 | 121.0° | 122.9° |
| C17 | N18 | C19 | H191 | 22.7° | 150.1° |
| C17 | N18 | C19 | H192 | 142.6° | 30.0° |
| C19 | C20 | O21 | C22 | 119.1° | 120.0° |
| C19 | C20 | O21 | H201 | 120.3° | 120.1° |
| C19 | C20 | C22 | H201 | 118.3° | 120.0° |
| C19 | C20 | C22 | N23 | 173.7° | 180.0° |
| C20 | C19 | N18 | H191 | 120.1° | 119.9° |
| C20 | C19 | N18 | H192 | 120.1° | 120.0° |
| C20 | C19 | N18 | C26 | 82.3° | 90.0° |
| C20 | C19 | H191 | H192 | 119.8° | 120.0° |
| C19 | C20 | C22 | H222 | 65.6° | 60.0° |
| C19 | C20 | C22 | H221 | 52.9° | 60.0° |
| C19 | C20 | O21 | H211 | 180.0° | 60.0° |
| O21 | C20 | C22 | H201 | 122.3° | 119.9° |
| O21 | C20 | C22 | N23 | 67.0° | 60.0° |
| O21 | C20 | C19 | N18 | 21.4° | 65.0° |
| O21 | C20 | C19 | H191 | 98.7° | 175.0° |
| O21 | C20 | C19 | H192 | 141.4° | 55.0° |
| O21 | C20 | C22 | H222 | 53.7° | 60.0° |
| O21 | C20 | C22 | H221 | 172.3° | 180.0° |
| C20 | C22 | N23 | H222 | 120.7° | 120.0° |
| C20 | C22 | N23 | H221 | 120.7° | 120.0° |
| C20 | C22 | N23 | C24 | 40.6° | 66.0° |
| C20 | C22 | N23 | C25 | 84.4° | 170.0° |
| C22 | C20 | C19 | N18 | 98.8° | 175.0° |
| C22 | C20 | C19 | H191 | 141.2° | 55.0° |
| C22 | C20 | C19 | H192 | 21.3° | 65.0° |
| C20 | C22 | H222 | H221 | 117.7° | 120.0° |
| C22 | C20 | O21 | H211 | 61.0° | 60.0° |
| C22 | N23 | C24 | C25 | 125.4° | 124.0° |
| C22 | N23 | C24 | H243 | 180.0° | 64.0° |
| C22 | N23 | C24 | H241 | 60.0° | 56.0° |
| C22 | N23 | C24 | H242 | 60.0° | 176.0° |
| N23 | C22 | C20 | H201 | 55.4° | 59.9° |
| N23 | C22 | H222 | H221 | 117.8° | 120.0° |
| C22 | N23 | C25 | H251 | 180.0° | 180.0° |
| C22 | N23 | C25 | H253 | 60.0° | 60.0° |
| C22 | N23 | C25 | H252 | 60.0° | 60.0° |
| N23 | C24 | H243 | H241 | 120.0° | 120.1° |
| N23 | C24 | H243 | H242 | 120.0° | 120.0° |
| N23 | C24 | H241 | H242 | 120.0° | 120.1° |
| C24 | N23 | C22 | H222 | 161.3° | 174.0° |
| C24 | N23 | C22 | H221 | 80.1° | 54.0° |
| C24 | N23 | C25 | H251 | 54.7° | 56.0° |
| C24 | N23 | C25 | H253 | 65.3° | 176.0° |
| C24 | N23 | C25 | H252 | 174.7° | 64.0° |
| C25 | N23 | C24 | H243 | 54.6° | 60.0° |
| C25 | N23 | C24 | H241 | 174.6° | 180.0° |
| C25 | N23 | C24 | H242 | 65.4° | 59.9° |
| C25 | N23 | C22 | H222 | 36.3° | 50.0° |
| C25 | N23 | C22 | H221 | 154.9° | 70.0° |
| N23 | C25 | H251 | H253 | 120.0° | 120.0° |
| N23 | C25 | H251 | H252 | 120.0° | 120.0° |
| N23 | C25 | H253 | H252 | 120.0° | 120.0° |
| C19 | N18 | C26 | O27 | 0.3° | 0.3° |
| C19 | N18 | C26 | N15 | 179.7° | 180.0° |
| N18 | C19 | C20 | H201 | 143.1° | 55.0° |
| C19 | N18 | C17 | H171 | 60.6° | 61.4° |
| C19 | N18 | C17 | H172 | 60.1° | 61.3° |
| N18 | C19 | H191 | H192 | 119.8° | 120.1° |
| N18 | C26 | O27 | N15 | 180.0° | 179.7° |
| N18 | C26 | N15 | C14 | 179.5° | 180.0° |
| C26 | N18 | C17 | H171 | 119.7° | 118.6° |
| C26 | N18 | C17 | H172 | 119.6° | 118.7° |
| C26 | N18 | C19 | H191 | 157.6° | 29.9° |
| C26 | N18 | C19 | H192 | 37.7° | 150.0° |
| O27 | C26 | N15 | C14 | 0.5° | 0.3° |
| N15 | C14 | C28 | C29 | 179.9° | 180.0° |
| N15 | C14 | C13 | C35 | 180.0° | 180.0° |
| N15 | C14 | C28 | H281 | 0.1° | 0.1° |
| C14 | N15 | C16 | H161 | 59.7° | 61.4° |
| C14 | N15 | C16 | H162 | 60.6° | 61.2° |
| C14 | C28 | C29 | H281 | 180.0° | 179.9° |
| C14 | C28 | C29 | C30 | 179.9° | 179.9° |
| C14 | C28 | C29 | C34 | 0.2° | 0.0° |
| C28 | C14 | C13 | C35 | 0.4° | 0.1° |
| C28 | C14 | N15 | C26 | 58.6° | 90.1° |
| C28 | C29 | C30 | F31 | 128.9° | 90.0° |
| C28 | C29 | C30 | F32 | 9.2° | 150.0° |
| C28 | C29 | C30 | F33 | 111.2° | 30.0° |
| C28 | C29 | C30 | C34 | 180.0° | 180.0° |
| C28 | C29 | C34 | C35 | 0.1° | 0.0° |
| C28 | C29 | C34 | H341 | 179.9° | 180.0° |
| F31 | C30 | F32 | F33 | 120.5° | 120.0° |
| F31 | C30 | F32 | C29 | 119.5° | 120.0° |
| F31 | C30 | F33 | C29 | 119.3° | 120.0° |
| F31 | C30 | C29 | C34 | 51.1° | 90.0° |
| F32 | C30 | F33 | C29 | 120.4° | 120.0° |
| F32 | C30 | C29 | C34 | 170.8° | 30.0° |
| F33 | C30 | C29 | C34 | 68.8° | 150.0° |
| C30 | C29 | C34 | C35 | 179.9° | 180.0° |
| C30 | C29 | C28 | H281 | 0.1° | 0.0° |
| C30 | C29 | C34 | H341 | 0.0° | 0.0° |
| C29 | C34 | C35 | H341 | 180.0° | 180.0° |
| C29 | C34 | C35 | C36 | 179.9° | 179.7° |
| C29 | C34 | C35 | C13 | 0.2° | 0.0° |
| C34 | C29 | C28 | H281 | 179.8° | 180.0° |
| C34 | C35 | C36 | C13 | 179.7° | 179.7° |
| C34 | C35 | C36 | F37 | 6.0° | 0.0° |
| C34 | C35 | C36 | F38 | 126.3° | 120.0° |
| C34 | C35 | C36 | F39 | 113.9° | 119.9° |
| C35 | C36 | F37 | F38 | 120.9° | 120.0° |
| C35 | C36 | F37 | F39 | 120.1° | 119.9° |
| C35 | C36 | F38 | F39 | 119.9° | 120.1° |
| C36 | C35 | C34 | H341 | 0.1° | 0.3° |
| F37 | C36 | F38 | F39 | 119.1° | 120.0° |
| F37 | C36 | C35 | C13 | 174.3° | 179.7° |
| F38 | C36 | C35 | C13 | 53.9° | 59.7° |
| F39 | C36 | C35 | C13 | 65.8° | 60.4° |
| C11 | C05 | C06 | H061 | 179.0° | 179.8° |
| C05 | C11 | C10 | H101 | 179.5° | 179.6° |
| C13 | C35 | C34 | H341 | 179.9° | 180.0° |
| C26 | N15 | C16 | H161 | 119.8° | 118.6° |
| C26 | N15 | C16 | H162 | 119.9° | 118.8° |
| H243 | C24 | H241 | H242 | 120.0° | 119.9° |
| H201 | C20 | C19 | H191 | 23.1° | 65.0° |
| H201 | C20 | C19 | H192 | 96.8° | 175.0° |
| H201 | C20 | C22 | H222 | 176.1° | 179.9° |
| H201 | C20 | C22 | H221 | 65.4° | 60.0° |
| H201 | C20 | O21 | H211 | 59.7° | 179.9° |
| H043 | C04 | H041 | H042 | 120.0° | 119.9° |
| H061 | C06 | C07 | H071 | 0.5° | 0.0° |
| H101 | C10 | C11 | H111 | 0.5° | 0.1° |
| H161 | C16 | C17 | H171 | 0.1° | 122.8° |
| H161 | C16 | C17 | H172 | 120.5° | 0.2° |
| H162 | C16 | C17 | H171 | 120.4° | 0.1° |
| H162 | C16 | C17 | H172 | 0.3° | 122.6° |
| H251 | C25 | H253 | H252 | 120.0° | 119.9° |
