A1AVW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | CL01 | sing | 1.74Å | 1.78Å | |
| N03 | C02 | doub | 1.32Å | 1.33Å | Aromatic |
| C04 | N03 | sing | 1.32Å | 1.31Å | Aromatic |
| C06 | N05 | sing | 1.47Å | 1.45Å | |
| C07 | C06 | sing | 1.53Å | 1.53Å | |
| N08 | C07 | sing | 1.47Å | 1.46Å | |
| C10 | C09 | sing | 1.53Å | 1.53Å | |
| C09 | N08 | sing | 1.47Å | 1.47Å | |
| S11 | N08 | sing | 1.66Å | 1.73Å | |
| O12 | S11 | doub | 1.42Å | 1.46Å | |
| O13 | S11 | doub | 1.42Å | 1.46Å | |
| C14 | S11 | sing | 1.76Å | 1.84Å | |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.41Å | Aromatic |
| C17 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.39Å | 1.39Å | Aromatic |
| N20 | C17 | sing | 1.40Å | 1.50Å | |
| C21 | N20 | sing | 1.35Å | 1.47Å | |
| O22 | C21 | doub | 1.22Å | 1.19Å | |
| C23 | C21 | sing | 1.47Å | 1.56Å | |
| C24 | C23 | doub | 1.40Å | 1.40Å | Aromatic |
| C26 | N25 | sing | 1.46Å | 1.48Å | |
| S27 | N25 | sing | 1.66Å | 1.74Å | |
| O28 | S27 | doub | 1.42Å | 1.47Å | |
| O29 | S27 | doub | 1.42Å | 1.47Å | |
| C30 | S27 | sing | 1.81Å | 1.83Å | |
| N25 | C24 | sing | 1.39Å | 1.48Å | |
| C31 | C24 | sing | 1.39Å | 1.40Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C33 | C32 | sing | 1.39Å | 1.39Å | Aromatic |
| C34 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| N05 | C04 | sing | 1.39Å | 1.48Å | |
| C35 | C04 | doub | 1.39Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | C36 | doub | 1.39Å | 1.39Å | Aromatic |
| C38 | C36 | sing | 1.51Å | 1.54Å | |
| F39 | C38 | sing | 1.40Å | 1.36Å | |
| F40 | C38 | sing | 1.40Å | 1.36Å | |
| F41 | C38 | sing | 1.40Å | 1.37Å | |
| C02 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| N05 | C10 | sing | 1.47Å | 1.45Å | |
| C14 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C34 | sing | 1.40Å | 1.40Å | Aromatic |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H303 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| N20 | H201 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL01 | C02 | N03 | 117.9° | 119.6° |
| CL01 | C02 | C37 | 120.1° | 119.5° |
| C02 | N03 | C04 | 121.7° | 121.6° |
| N03 | C02 | C37 | 122.0° | 120.9° |
| N03 | C04 | N05 | 118.7° | 119.7° |
| N03 | C04 | C35 | 120.4° | 120.6° |
| N05 | C06 | C07 | 108.9° | 109.3° |
| C06 | N05 | C04 | 121.9° | 111.0° |
| C06 | N05 | C10 | 110.9° | 111.2° |
| N05 | C06 | H062 | 109.6° | 109.5° |
| N05 | C06 | H061 | 109.6° | 109.5° |
| C06 | C07 | N08 | 112.1° | 108.5° |
| C07 | C06 | H062 | 109.6° | 109.5° |
| C07 | C06 | H061 | 109.6° | 109.5° |
| C06 | C07 | H072 | 108.8° | 109.7° |
| C06 | C07 | H071 | 108.8° | 109.6° |
| C07 | N08 | C09 | 111.1° | 118.3° |
| C07 | N08 | S11 | 116.1° | 120.9° |
| N08 | C07 | H072 | 108.8° | 109.6° |
| N08 | C07 | H071 | 108.8° | 109.8° |
| C10 | C09 | N08 | 113.1° | 108.5° |
| C09 | C10 | N05 | 109.4° | 109.3° |
| C09 | C10 | H102 | 109.5° | 109.5° |
| C09 | C10 | H101 | 109.5° | 109.5° |
| C10 | C09 | H091 | 108.6° | 109.6° |
| C10 | C09 | H092 | 108.5° | 109.6° |
| C09 | N08 | S11 | 116.6° | 120.9° |
| N08 | C09 | H091 | 108.6° | 109.6° |
| N08 | C09 | H092 | 108.6° | 109.6° |
| N08 | S11 | O12 | 110.5° | 106.4° |
| N08 | S11 | O13 | 111.3° | 106.4° |
| N08 | S11 | C14 | 104.9° | 107.3° |
| O12 | S11 | O13 | 105.3° | 123.2° |
| O12 | S11 | C14 | 112.4° | 106.4° |
| O13 | S11 | C14 | 112.5° | 106.4° |
| S11 | C14 | C15 | 120.8° | 119.9° |
| S11 | C14 | C19 | 117.8° | 119.9° |
| C14 | C15 | C16 | 119.1° | 120.1° |
| C15 | C14 | C19 | 121.4° | 120.2° |
| C14 | C15 | H151 | 120.5° | 119.9° |
| C15 | C16 | C17 | 119.3° | 119.9° |
| C16 | C15 | H151 | 120.4° | 120.0° |
| C15 | C16 | H161 | 120.4° | 120.0° |
| C16 | C17 | C18 | 121.0° | 119.9° |
| C16 | C17 | N20 | 122.8° | 120.1° |
| C17 | C16 | H161 | 120.3° | 120.0° |
| C19 | C18 | C17 | 119.8° | 119.9° |
| C18 | C19 | C14 | 119.4° | 120.1° |
| C19 | C18 | H181 | 120.1° | 120.0° |
| C18 | C19 | H191 | 120.3° | 120.0° |
| C18 | C17 | N20 | 116.1° | 120.0° |
| C17 | C18 | H181 | 120.1° | 120.1° |
| C17 | N20 | C21 | 127.5° | 120.0° |
| C17 | N20 | H201 | 116.2° | 120.0° |
| N20 | C21 | O22 | 123.1° | 120.0° |
| N20 | C21 | C23 | 113.2° | 120.0° |
| C21 | N20 | H201 | 116.2° | 120.1° |
| O22 | C21 | C23 | 123.7° | 120.0° |
| C21 | C23 | C24 | 123.7° | 120.2° |
| C21 | C23 | C34 | 116.4° | 120.2° |
| C23 | C24 | N25 | 121.8° | 120.2° |
| C23 | C24 | C31 | 119.2° | 119.7° |
| C24 | C23 | C34 | 119.8° | 119.6° |
| C26 | N25 | S27 | 120.4° | 120.0° |
| C26 | N25 | C24 | 120.1° | 120.0° |
| N25 | C26 | H262 | 109.5° | 109.5° |
| N25 | C26 | H263 | 109.4° | 109.5° |
| N25 | C26 | H261 | 109.4° | 109.5° |
| N25 | S27 | O28 | 111.4° | 104.3° |
| N25 | S27 | O29 | 111.9° | 104.3° |
| N25 | S27 | C30 | 109.7° | 104.5° |
| S27 | N25 | C24 | 119.5° | 120.0° |
| O28 | S27 | O29 | 102.0° | 121.0° |
| O28 | S27 | C30 | 110.6° | 110.5° |
| O29 | S27 | C30 | 111.1° | 110.6° |
| S27 | C30 | H301 | 109.5° | 109.5° |
| S27 | C30 | H303 | 109.5° | 109.5° |
| S27 | C30 | H302 | 109.5° | 109.5° |
| N25 | C24 | C31 | 119.0° | 120.2° |
| C24 | C31 | C32 | 120.6° | 120.1° |
| C24 | C31 | H311 | 119.7° | 119.9° |
| C31 | C32 | C33 | 120.0° | 120.4° |
| C32 | C31 | H311 | 119.7° | 120.0° |
| C31 | C32 | H321 | 120.0° | 119.8° |
| C32 | C33 | C34 | 119.4° | 120.3° |
| C33 | C32 | H321 | 120.0° | 119.8° |
| C32 | C33 | H331 | 120.3° | 119.8° |
| C33 | C34 | C23 | 120.9° | 119.9° |
| C34 | C33 | H331 | 120.3° | 119.8° |
| C33 | C34 | H341 | 119.5° | 120.0° |
| N05 | C04 | C35 | 120.9° | 119.7° |
| C04 | N05 | C10 | 123.6° | 111.0° |
| C04 | C35 | C36 | 119.3° | 119.1° |
| C04 | C35 | H351 | 120.3° | 120.4° |
| C35 | C36 | C37 | 119.0° | 118.5° |
| C35 | C36 | C38 | 120.0° | 120.8° |
| C36 | C35 | H351 | 120.4° | 120.4° |
| C37 | C36 | C38 | 121.0° | 120.7° |
| C36 | C37 | C02 | 117.6° | 119.3° |
| C36 | C37 | H371 | 121.2° | 120.3° |
| C36 | C38 | F39 | 109.1° | 109.5° |
| C36 | C38 | F40 | 109.9° | 109.5° |
| C36 | C38 | F41 | 109.3° | 109.5° |
| F39 | C38 | F40 | 109.5° | 109.4° |
| F39 | C38 | F41 | 110.0° | 109.5° |
| F40 | C38 | F41 | 109.1° | 109.5° |
| C02 | C37 | H371 | 121.2° | 120.4° |
| N05 | C10 | H102 | 109.5° | 109.5° |
| N05 | C10 | H101 | 109.5° | 109.5° |
| C14 | C19 | H191 | 120.3° | 120.0° |
| C23 | C34 | H341 | 119.6° | 120.1° |
| H102 | C10 | H101 | 109.4° | 109.5° |
| H262 | C26 | H263 | 109.5° | 109.4° |
| H262 | C26 | H261 | 109.5° | 109.4° |
| H263 | C26 | H261 | 109.5° | 109.5° |
| H062 | C06 | H061 | 109.5° | 109.5° |
| H072 | C07 | H071 | 109.5° | 109.6° |
| H091 | C09 | H092 | 109.4° | 109.8° |
| H301 | C30 | H303 | 109.4° | 109.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H303 | C30 | H302 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL01 | C02 | N03 | C37 | 179.9° | 179.7° |
| CL01 | C02 | N03 | C04 | 180.0° | 180.0° |
| CL01 | C02 | C37 | C36 | 179.9° | 180.0° |
| CL01 | C02 | C37 | H371 | 0.1° | 0.1° |
| C02 | N03 | C04 | N05 | 180.0° | 180.0° |
| C02 | N03 | C04 | C35 | 0.2° | 0.1° |
| N03 | C02 | C37 | C36 | 0.2° | 0.4° |
| N03 | C02 | C37 | H371 | 179.8° | 179.8° |
| N03 | C04 | N05 | C06 | 14.9° | 0.1° |
| N03 | C04 | N05 | C35 | 179.8° | 179.9° |
| N03 | C04 | C35 | C36 | 0.3° | 0.2° |
| C04 | N03 | C02 | C37 | 0.1° | 0.3° |
| N03 | C04 | N05 | C10 | 171.3° | 124.3° |
| N03 | C04 | C35 | H351 | 179.7° | 180.0° |
| N05 | C06 | C07 | H062 | 119.9° | 120.0° |
| N05 | C06 | C07 | H061 | 119.9° | 119.9° |
| N05 | C06 | C07 | N08 | 57.9° | 53.9° |
| C06 | N05 | C10 | C09 | 59.6° | 63.1° |
| C06 | N05 | C04 | C10 | 156.4° | 124.2° |
| C06 | N05 | C04 | C35 | 165.3° | 180.0° |
| C06 | N05 | C10 | H102 | 179.6° | 176.9° |
| C06 | N05 | C10 | H101 | 60.4° | 56.9° |
| N05 | C06 | H062 | H061 | 120.3° | 120.0° |
| N05 | C06 | C07 | H072 | 62.5° | 65.8° |
| N05 | C06 | C07 | H071 | 178.3° | 173.8° |
| C06 | C07 | N08 | H072 | 120.4° | 119.7° |
| C06 | C07 | N08 | H071 | 120.4° | 119.8° |
| C06 | C07 | N08 | C09 | 52.5° | 51.2° |
| C06 | C07 | N08 | S11 | 171.1° | 128.8° |
| C07 | C06 | N05 | C04 | 139.4° | 172.8° |
| C07 | C06 | N05 | C10 | 61.5° | 63.2° |
| C07 | C06 | H062 | H061 | 120.3° | 120.1° |
| C06 | C07 | H072 | H071 | 118.8° | 120.4° |
| C07 | N08 | C09 | C10 | 50.9° | 51.2° |
| C07 | N08 | C09 | S11 | 136.1° | 180.0° |
| C07 | N08 | S11 | O12 | 48.7° | 156.4° |
| C07 | N08 | S11 | O13 | 165.3° | 23.5° |
| C07 | N08 | S11 | C14 | 72.7° | 90.0° |
| N08 | C07 | C06 | H062 | 177.8° | 66.1° |
| N08 | C07 | C06 | H061 | 62.1° | 173.8° |
| N08 | C07 | H072 | H071 | 118.8° | 120.6° |
| C07 | N08 | C09 | H091 | 171.5° | 170.8° |
| C07 | N08 | C09 | H092 | 69.6° | 68.5° |
| C10 | C09 | N08 | H091 | 120.6° | 119.7° |
| C10 | C09 | N08 | H092 | 120.5° | 119.7° |
| C10 | C09 | N08 | S11 | 173.0° | 128.8° |
| C09 | C10 | N05 | C04 | 141.8° | 172.8° |
| C09 | C10 | N05 | H102 | 120.0° | 120.0° |
| C09 | C10 | N05 | H101 | 120.0° | 120.0° |
| C09 | C10 | H102 | H101 | 120.0° | 120.1° |
| C10 | C09 | H091 | H092 | 118.3° | 120.5° |
| C09 | N08 | S11 | O12 | 177.4° | 23.6° |
| C09 | N08 | S11 | O13 | 60.8° | 156.5° |
| C09 | N08 | S11 | C14 | 61.2° | 90.0° |
| N08 | C09 | C10 | N05 | 54.1° | 53.8° |
| N08 | C09 | C10 | H102 | 174.0° | 173.8° |
| N08 | C09 | C10 | H101 | 66.0° | 66.2° |
| C09 | N08 | C07 | H072 | 67.8° | 68.5° |
| C09 | N08 | C07 | H071 | 172.9° | 171.0° |
| N08 | C09 | H091 | H092 | 118.4° | 120.5° |
| N08 | S11 | O12 | O13 | 120.3° | 123.0° |
| N08 | S11 | O12 | C14 | 116.8° | 114.1° |
| N08 | S11 | O13 | C14 | 117.4° | 114.1° |
| N08 | S11 | C14 | C15 | 90.1° | 90.0° |
| N08 | S11 | C14 | C19 | 88.6° | 90.0° |
| S11 | N08 | C07 | H072 | 68.5° | 111.5° |
| S11 | N08 | C07 | H071 | 50.7° | 9.0° |
| S11 | N08 | C09 | H091 | 52.4° | 9.2° |
| S11 | N08 | C09 | H092 | 66.5° | 111.5° |
| O12 | S11 | O13 | C14 | 122.8° | 122.9° |
| O12 | S11 | C14 | C15 | 30.0° | 156.5° |
| O12 | S11 | C14 | C19 | 151.3° | 23.6° |
| O13 | S11 | C14 | C15 | 148.7° | 23.6° |
| O13 | S11 | C14 | C19 | 32.6° | 156.5° |
| S11 | C14 | C15 | C19 | 178.6° | 179.9° |
| S11 | C14 | C15 | C16 | 179.2° | 179.7° |
| S11 | C14 | C19 | C18 | 179.1° | 180.0° |
| S11 | C14 | C15 | H151 | 0.8° | 0.0° |
| S11 | C14 | C19 | H191 | 0.9° | 0.1° |
| C14 | C15 | C16 | H151 | 180.0° | 179.7° |
| C14 | C15 | C16 | C17 | 0.1° | 0.0° |
| C15 | C14 | C19 | C18 | 0.4° | 0.0° |
| C14 | C15 | C16 | H161 | 179.9° | 180.0° |
| C15 | C14 | C19 | H191 | 179.6° | 180.0° |
| C15 | C16 | C17 | H161 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 1.0° | 0.6° |
| C15 | C16 | C17 | N20 | 178.9° | 180.0° |
| C16 | C15 | C14 | C19 | 0.6° | 0.2° |
| C16 | C17 | C18 | C19 | 1.2° | 0.8° |
| C16 | C17 | C18 | N20 | 178.0° | 179.4° |
| C16 | C17 | N20 | C21 | 21.1° | 37.7° |
| C17 | C16 | C15 | H151 | 179.9° | 179.6° |
| C16 | C17 | C18 | H181 | 178.8° | 180.0° |
| C16 | C17 | N20 | H201 | 158.9° | 142.2° |
| C19 | C18 | C17 | H181 | 180.0° | 179.2° |
| C19 | C18 | C17 | N20 | 179.3° | 179.8° |
| C18 | C19 | C14 | H191 | 180.0° | 180.0° |
| C18 | C17 | N20 | C21 | 160.9° | 142.9° |
| C17 | C18 | C19 | C14 | 0.5° | 0.6° |
| C18 | C17 | C16 | H161 | 179.0° | 179.5° |
| C17 | C18 | C19 | H191 | 179.5° | 179.5° |
| C18 | C17 | N20 | H201 | 19.1° | 37.2° |
| C17 | N20 | C21 | H201 | 180.0° | 180.0° |
| C17 | N20 | C21 | O22 | 0.6° | 4.5° |
| C17 | N20 | C21 | C23 | 179.0° | 175.5° |
| N20 | C17 | C16 | H161 | 1.1° | 0.1° |
| N20 | C17 | C18 | H181 | 0.7° | 0.6° |
| N20 | C21 | O22 | C23 | 179.5° | 180.0° |
| N20 | C21 | C23 | C24 | 128.6° | 177.3° |
| N20 | C21 | C23 | C34 | 49.7° | 2.7° |
| O22 | C21 | C23 | C24 | 51.8° | 2.7° |
| O22 | C21 | C23 | C34 | 129.9° | 177.3° |
| O22 | C21 | N20 | H201 | 179.4° | 175.5° |
| C21 | C23 | C24 | C34 | 178.3° | 180.0° |
| C21 | C23 | C24 | N25 | 0.9° | 0.3° |
| C21 | C23 | C24 | C31 | 179.2° | 180.0° |
| C21 | C23 | C34 | C33 | 179.5° | 180.0° |
| C21 | C23 | C34 | H341 | 0.6° | 0.0° |
| C23 | C21 | N20 | H201 | 1.0° | 4.6° |
| C23 | C24 | N25 | C26 | 109.3° | 94.4° |
| C23 | C24 | N25 | S27 | 72.4° | 85.6° |
| C23 | C24 | N25 | C31 | 179.9° | 179.7° |
| C23 | C24 | C31 | C32 | 0.3° | 0.0° |
| C24 | C23 | C34 | C33 | 1.1° | 0.0° |
| C23 | C24 | C31 | H311 | 179.7° | 180.0° |
| C24 | C23 | C34 | H341 | 179.0° | 180.0° |
| C26 | N25 | S27 | C24 | 178.3° | 180.0° |
| C26 | N25 | S27 | O28 | 150.0° | 27.5° |
| C26 | N25 | S27 | O29 | 36.6° | 155.4° |
| C26 | N25 | S27 | C30 | 87.2° | 88.6° |
| C26 | N25 | C24 | C31 | 70.6° | 85.9° |
| N25 | C26 | H262 | H263 | 120.0° | 120.0° |
| N25 | C26 | H262 | H261 | 120.0° | 120.0° |
| N25 | C26 | H263 | H261 | 120.0° | 120.0° |
| N25 | S27 | O28 | O29 | 119.5° | 116.7° |
| N25 | S27 | O28 | C30 | 122.3° | 111.8° |
| N25 | S27 | O29 | C30 | 123.0° | 111.8° |
| S27 | N25 | C24 | C31 | 107.7° | 94.1° |
| S27 | N25 | C26 | H262 | 180.0° | 90.0° |
| S27 | N25 | C26 | H263 | 60.0° | 30.0° |
| S27 | N25 | C26 | H261 | 60.0° | 150.0° |
| N25 | S27 | C30 | H301 | 180.0° | 54.9° |
| N25 | S27 | C30 | H303 | 60.0° | 65.1° |
| N25 | S27 | C30 | H302 | 60.0° | 175.0° |
| O28 | S27 | O29 | C30 | 117.9° | 131.5° |
| O28 | S27 | N25 | C24 | 31.7° | 152.5° |
| O28 | S27 | C30 | H301 | 56.7° | 56.8° |
| O28 | S27 | C30 | H303 | 63.2° | 176.8° |
| O28 | S27 | C30 | H302 | 176.8° | 63.3° |
| O29 | S27 | N25 | C24 | 145.1° | 24.7° |
| O29 | S27 | C30 | H301 | 55.8° | 166.5° |
| O29 | S27 | C30 | H303 | 175.8° | 46.5° |
| O29 | S27 | C30 | H302 | 64.2° | 73.4° |
| C30 | S27 | N25 | C24 | 91.1° | 91.4° |
| S27 | C30 | H301 | H303 | 120.0° | 120.0° |
| S27 | C30 | H301 | H302 | 120.0° | 120.0° |
| S27 | C30 | H303 | H302 | 120.0° | 119.9° |
| N25 | C24 | C31 | C32 | 179.7° | 179.7° |
| N25 | C24 | C23 | C34 | 179.2° | 179.7° |
| C24 | N25 | C26 | H262 | 1.7° | 90.0° |
| C24 | N25 | C26 | H263 | 121.7° | 150.0° |
| C24 | N25 | C26 | H261 | 118.3° | 30.0° |
| N25 | C24 | C31 | H311 | 0.3° | 0.2° |
| C24 | C31 | C32 | H311 | 180.0° | 180.0° |
| C24 | C31 | C32 | C33 | 0.1° | 0.0° |
| C31 | C24 | C23 | C34 | 0.9° | 0.0° |
| C24 | C31 | C32 | H321 | 179.9° | 179.9° |
| C31 | C32 | C33 | H321 | 180.0° | 179.9° |
| C31 | C32 | C33 | C34 | 0.1° | 0.0° |
| C31 | C32 | C33 | H331 | 180.0° | 180.0° |
| C32 | C33 | C34 | H331 | 180.0° | 180.0° |
| C32 | C33 | C34 | C23 | 0.6° | 0.0° |
| C33 | C32 | C31 | H311 | 179.9° | 179.9° |
| C32 | C33 | C34 | H341 | 179.4° | 180.0° |
| C33 | C34 | C23 | H341 | 180.0° | 180.0° |
| C34 | C33 | C32 | H321 | 179.9° | 179.9° |
| N05 | C04 | C35 | C36 | 179.9° | 179.7° |
| C04 | N05 | C10 | H102 | 21.8° | 52.8° |
| C04 | N05 | C10 | H101 | 98.2° | 67.2° |
| C04 | N05 | C06 | H062 | 19.5° | 67.2° |
| C04 | N05 | C06 | H061 | 100.6° | 52.8° |
| N05 | C04 | C35 | H351 | 0.1° | 0.1° |
| C04 | C35 | C36 | H351 | 180.0° | 179.8° |
| C04 | C35 | C36 | C37 | 0.1° | 0.2° |
| C04 | C35 | C36 | C38 | 179.8° | 180.0° |
| C35 | C04 | N05 | C10 | 8.9° | 55.7° |
| C35 | C36 | C37 | C38 | 180.0° | 179.8° |
| C35 | C36 | C38 | F39 | 156.3° | 90.0° |
| C35 | C36 | C38 | F40 | 36.2° | 150.0° |
| C35 | C36 | C38 | F41 | 83.4° | 30.0° |
| C35 | C36 | C37 | C02 | 0.1° | 0.1° |
| C35 | C36 | C37 | H371 | 179.9° | 179.9° |
| C37 | C36 | C38 | F39 | 23.7° | 89.8° |
| C37 | C36 | C38 | F40 | 143.8° | 30.2° |
| C37 | C36 | C38 | F41 | 96.6° | 150.2° |
| C36 | C37 | C02 | H371 | 180.0° | 179.9° |
| C37 | C36 | C35 | H351 | 179.9° | 180.0° |
| C36 | C38 | F39 | F40 | 120.3° | 120.0° |
| C36 | C38 | F39 | F41 | 119.9° | 120.0° |
| C36 | C38 | F40 | F41 | 119.8° | 120.0° |
| C38 | C36 | C37 | C02 | 179.9° | 179.7° |
| C38 | C36 | C35 | H351 | 0.1° | 0.2° |
| C38 | C36 | C37 | H371 | 0.1° | 0.1° |
| F39 | C38 | F40 | F41 | 120.4° | 120.1° |
| N05 | C10 | H102 | H101 | 120.0° | 120.1° |
| C10 | N05 | C06 | H062 | 178.6° | 56.9° |
| C10 | N05 | C06 | H061 | 58.4° | 176.9° |
| N05 | C10 | C09 | H091 | 174.6° | 173.5° |
| N05 | C10 | C09 | H092 | 66.5° | 65.8° |
| C19 | C14 | C15 | H151 | 179.4° | 179.9° |
| C14 | C19 | C18 | H181 | 179.5° | 179.7° |
| C23 | C34 | C33 | H331 | 179.4° | 180.0° |
| H102 | C10 | C09 | H091 | 65.4° | 66.5° |
| H102 | C10 | C09 | H092 | 53.5° | 54.1° |
| H101 | C10 | C09 | H091 | 54.6° | 53.5° |
| H101 | C10 | C09 | H092 | 173.5° | 174.2° |
| H151 | C15 | C16 | H161 | 0.1° | 0.3° |
| H262 | C26 | H263 | H261 | 120.0° | 119.9° |
| H062 | C06 | C07 | H072 | 57.4° | 174.2° |
| H062 | C06 | C07 | H071 | 61.8° | 53.8° |
| H061 | C06 | C07 | H072 | 177.6° | 54.1° |
| H061 | C06 | C07 | H071 | 58.4° | 66.3° |
| H181 | C18 | C19 | H191 | 0.5° | 0.3° |
| H301 | C30 | H303 | H302 | 120.0° | 120.1° |
| H311 | C31 | C32 | H321 | 0.1° | 0.0° |
| H321 | C32 | C33 | H331 | 0.0° | 0.1° |
| H331 | C33 | C34 | H341 | 0.6° | 0.0° |
