X08
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | sing | 1.54Å | 1.68Å | |
| C26 | S27 | sing | 1.85Å | 1.53Å | |
| N24 | C25 | sing | 1.47Å | 1.34Å | |
| N24 | C22 | sing | 1.34Å | 1.55Å | |
| C25 | C20 | sing | 1.53Å | 1.66Å | |
| S27 | C19 | sing | 1.84Å | 1.74Å | |
| O23 | C22 | doub | 1.22Å | 1.23Å | |
| C22 | N21 | sing | 1.34Å | 1.51Å | |
| C20 | C19 | sing | 1.54Å | 1.45Å | |
| C20 | N21 | sing | 1.47Å | 1.39Å | |
| C19 | C18 | sing | 1.53Å | 1.59Å | |
| C18 | C17 | sing | 1.53Å | 1.55Å | |
| C17 | C16 | sing | 1.53Å | 1.55Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C13 | sing | 1.51Å | 1.53Å | |
| C10 | N01 | sing | 1.47Å | 1.48Å | |
| C10 | C11 | sing | 1.53Å | 1.55Å | |
| N12 | C13 | sing | 1.35Å | 1.45Å | |
| N12 | C11 | sing | 1.46Å | 1.47Å | |
| C13 | O14 | doub | 1.21Å | 1.19Å | |
| N01 | C02 | sing | 1.47Å | 1.48Å | |
| N08 | C07 | doub | 1.32Å | 1.34Å | Aromatic |
| N08 | C03 | sing | 1.32Å | 1.33Å | Aromatic |
| C02 | C03 | sing | 1.51Å | 1.56Å | |
| C07 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C03 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
| C06 | C09 | sing | 1.51Å | 1.53Å | |
| C06 | C05 | doub | 1.39Å | 1.38Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.40Å | Aromatic |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C09 | H093 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| N01 | H011 | sing | 1.01Å | 1.00Å | |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| N21 | H211 | sing | 0.97Å | 1.00Å | |
| N24 | H241 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | S27 | 108.1° | 102.7° |
| C26 | C25 | N24 | 110.7° | 109.5° |
| C26 | C25 | C20 | 102.0° | 112.4° |
| C26 | C25 | H251 | 110.5° | 110.3° |
| C25 | C26 | H262 | 109.8° | 110.8° |
| C25 | C26 | H261 | 109.8° | 110.8° |
| C26 | S27 | C19 | 94.2° | 94.6° |
| S27 | C26 | H262 | 109.8° | 111.0° |
| S27 | C26 | H261 | 109.8° | 110.5° |
| C25 | N24 | C22 | 110.9° | 109.1° |
| N24 | C25 | C20 | 105.6° | 104.0° |
| N24 | C25 | H251 | 116.1° | 110.2° |
| C25 | N24 | H241 | 124.5° | 125.4° |
| N24 | C22 | O23 | 127.0° | 123.1° |
| N24 | C22 | N21 | 106.9° | 113.9° |
| C22 | N24 | H241 | 124.6° | 125.5° |
| C25 | C20 | C19 | 104.1° | 112.4° |
| C25 | C20 | N21 | 108.3° | 104.0° |
| C25 | C20 | H201 | 107.5° | 110.6° |
| C20 | C25 | H251 | 110.8° | 110.2° |
| S27 | C19 | C20 | 107.0° | 102.9° |
| S27 | C19 | C18 | 114.9° | 110.8° |
| S27 | C19 | H191 | 107.2° | 110.7° |
| O23 | C22 | N21 | 125.9° | 123.1° |
| C22 | N21 | C20 | 107.8° | 109.0° |
| C22 | N21 | H211 | 126.1° | 125.5° |
| C19 | C20 | N21 | 115.2° | 109.2° |
| C20 | C19 | C18 | 108.1° | 110.8° |
| C20 | C19 | H191 | 110.8° | 110.8° |
| C19 | C20 | H201 | 110.2° | 110.3° |
| N21 | C20 | H201 | 111.1° | 110.2° |
| C20 | N21 | H211 | 126.1° | 125.5° |
| C19 | C18 | C17 | 109.3° | 109.5° |
| C19 | C18 | H182 | 109.5° | 109.5° |
| C19 | C18 | H181 | 109.5° | 109.4° |
| C18 | C19 | H191 | 108.8° | 110.6° |
| C18 | C17 | C16 | 110.2° | 109.5° |
| C18 | C17 | H172 | 109.3° | 109.4° |
| C18 | C17 | H171 | 109.3° | 109.4° |
| C17 | C18 | H182 | 109.5° | 109.5° |
| C17 | C18 | H181 | 109.5° | 109.5° |
| C17 | C16 | C15 | 109.5° | 109.5° |
| C17 | C16 | H161 | 109.5° | 109.5° |
| C17 | C16 | H162 | 109.5° | 109.5° |
| C16 | C17 | H172 | 109.3° | 109.5° |
| C16 | C17 | H171 | 109.3° | 109.5° |
| C16 | C15 | C13 | 115.0° | 109.5° |
| C16 | C15 | H152 | 108.1° | 109.5° |
| C16 | C15 | H151 | 108.1° | 109.5° |
| C15 | C16 | H161 | 109.5° | 109.4° |
| C15 | C16 | H162 | 109.5° | 109.4° |
| C15 | C13 | N12 | 117.9° | 120.0° |
| C15 | C13 | O14 | 122.9° | 120.0° |
| C13 | C15 | H152 | 108.1° | 109.4° |
| C13 | C15 | H151 | 108.1° | 109.5° |
| N01 | C10 | C11 | 110.0° | 109.5° |
| C10 | N01 | C02 | 114.2° | 111.0° |
| N01 | C10 | H101 | 109.4° | 109.5° |
| N01 | C10 | H102 | 109.3° | 109.4° |
| C10 | N01 | H011 | 108.3° | 111.0° |
| C10 | C11 | N12 | 114.3° | 109.5° |
| C11 | C10 | H101 | 109.3° | 109.5° |
| C11 | C10 | H102 | 109.3° | 109.5° |
| C10 | C11 | H111 | 108.2° | 109.5° |
| C10 | C11 | H112 | 108.3° | 109.5° |
| C13 | N12 | C11 | 116.2° | 120.0° |
| N12 | C13 | O14 | 119.2° | 120.0° |
| C13 | N12 | H121 | 121.9° | 120.0° |
| N12 | C11 | H111 | 108.3° | 109.5° |
| N12 | C11 | H112 | 108.3° | 109.5° |
| C11 | N12 | H121 | 121.9° | 120.0° |
| N01 | C02 | C03 | 108.9° | 109.5° |
| N01 | C02 | H021 | 109.6° | 109.5° |
| N01 | C02 | H022 | 109.6° | 109.5° |
| C02 | N01 | H011 | 108.3° | 111.0° |
| C07 | N08 | C03 | 121.6° | 121.7° |
| N08 | C07 | C06 | 120.6° | 120.8° |
| N08 | C07 | H071 | 119.7° | 119.6° |
| N08 | C03 | C02 | 121.0° | 119.6° |
| N08 | C03 | C04 | 119.8° | 120.7° |
| C02 | C03 | C04 | 119.2° | 119.7° |
| C03 | C02 | H021 | 109.6° | 109.5° |
| C03 | C02 | H022 | 109.6° | 109.4° |
| C07 | C06 | C09 | 121.8° | 120.4° |
| C07 | C06 | C05 | 120.0° | 119.1° |
| C06 | C07 | H071 | 119.7° | 119.6° |
| C03 | C04 | C05 | 120.5° | 119.2° |
| C03 | C04 | H041 | 119.7° | 120.4° |
| C09 | C06 | C05 | 118.2° | 120.5° |
| C06 | C09 | H092 | 109.5° | 109.5° |
| C06 | C09 | H093 | 109.5° | 109.5° |
| C06 | C09 | H091 | 109.5° | 109.4° |
| C06 | C05 | C04 | 117.6° | 118.4° |
| C06 | C05 | H051 | 121.2° | 120.8° |
| C05 | C04 | H041 | 119.7° | 120.4° |
| C04 | C05 | H051 | 121.2° | 120.8° |
| H021 | C02 | H022 | 109.4° | 109.5° |
| H092 | C09 | H093 | 109.5° | 109.5° |
| H092 | C09 | H091 | 109.4° | 109.5° |
| H093 | C09 | H091 | 109.5° | 109.5° |
| H101 | C10 | H102 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H152 | C15 | H151 | 109.5° | 109.5° |
| H161 | C16 | H162 | 109.5° | 109.5° |
| H172 | C17 | H171 | 109.5° | 109.5° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H262 | C26 | H261 | 109.4° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | S27 | H262 | 119.8° | 118.4° |
| C25 | C26 | S27 | H261 | 119.8° | 118.2° |
| C26 | C25 | N24 | C20 | 109.7° | 120.3° |
| C26 | C25 | N24 | H251 | 127.1° | 121.5° |
| C26 | C25 | N24 | C22 | 108.2° | 120.3° |
| C26 | C25 | C20 | H251 | 117.6° | 123.5° |
| C25 | C26 | S27 | C19 | 39.5° | 34.8° |
| C26 | C25 | C20 | C19 | 12.7° | 0.4° |
| C26 | C25 | C20 | N21 | 110.4° | 118.3° |
| C26 | C25 | C20 | H201 | 129.5° | 123.3° |
| C25 | C26 | H262 | H261 | 120.6° | 123.3° |
| C26 | C25 | N24 | H241 | 71.8° | 59.7° |
| S27 | C26 | C25 | N24 | 90.7° | 90.2° |
| S27 | C26 | C25 | C20 | 21.3° | 24.9° |
| C26 | S27 | C19 | C20 | 50.7° | 34.6° |
| C26 | S27 | C19 | C18 | 170.8° | 153.1° |
| C26 | S27 | C19 | H191 | 68.2° | 83.8° |
| S27 | C26 | C25 | H251 | 139.1° | 148.3° |
| S27 | C26 | H262 | H261 | 120.7° | 123.2° |
| C25 | N24 | C22 | H241 | 180.0° | 180.0° |
| N24 | C25 | C20 | H251 | 126.6° | 118.2° |
| C25 | N24 | C22 | O23 | 177.7° | 180.0° |
| C25 | N24 | C22 | N21 | 2.5° | 0.0° |
| N24 | C25 | C20 | C19 | 128.5° | 118.0° |
| N24 | C25 | C20 | N21 | 5.4° | 0.1° |
| N24 | C25 | C20 | H201 | 114.6° | 118.3° |
| N24 | C25 | C26 | H262 | 149.5° | 151.2° |
| N24 | C25 | C26 | H261 | 29.1° | 27.9° |
| C22 | N24 | C25 | C20 | 1.5° | 0.0° |
| N24 | C22 | O23 | N21 | 174.3° | 180.0° |
| N24 | C22 | N21 | C20 | 6.1° | 0.0° |
| C22 | N24 | C25 | H251 | 124.7° | 118.2° |
| N24 | C22 | N21 | H211 | 174.0° | 179.9° |
| C25 | C20 | C19 | S27 | 38.6° | 24.5° |
| C25 | C20 | N21 | C22 | 6.9° | 0.1° |
| C25 | C20 | C19 | N21 | 118.4° | 114.9° |
| C25 | C20 | C19 | H201 | 115.0° | 123.9° |
| C25 | C20 | N21 | H201 | 117.8° | 118.6° |
| C25 | C20 | C19 | C18 | 163.0° | 142.9° |
| C25 | C20 | C19 | H191 | 77.9° | 93.9° |
| C20 | C25 | C26 | H262 | 98.5° | 93.7° |
| C20 | C25 | C26 | H261 | 141.1° | 143.0° |
| C25 | C20 | N21 | H211 | 173.1° | 180.0° |
| C20 | C25 | N24 | H241 | 178.5° | 180.0° |
| S27 | C19 | C20 | C18 | 124.4° | 118.4° |
| S27 | C19 | C20 | H191 | 116.5° | 118.4° |
| S27 | C19 | C20 | N21 | 79.8° | 90.4° |
| S27 | C19 | C18 | H191 | 120.1° | 123.2° |
| S27 | C19 | C18 | C17 | 68.0° | 68.9° |
| S27 | C19 | C18 | H182 | 51.9° | 171.1° |
| S27 | C19 | C18 | H181 | 172.0° | 51.1° |
| S27 | C19 | C20 | H201 | 153.6° | 148.4° |
| C19 | S27 | C26 | H262 | 80.2° | 83.6° |
| C19 | S27 | C26 | H261 | 159.4° | 153.0° |
| O23 | C22 | N21 | C20 | 178.7° | 180.0° |
| O23 | C22 | N21 | H211 | 1.3° | 0.1° |
| O23 | C22 | N24 | H241 | 2.2° | 0.0° |
| C22 | N21 | C20 | C19 | 122.9° | 120.2° |
| C22 | N21 | C20 | H211 | 180.0° | 179.9° |
| C22 | N21 | C20 | H201 | 110.9° | 118.5° |
| N21 | C22 | N24 | H241 | 177.5° | 180.0° |
| C19 | C20 | N21 | H201 | 126.2° | 121.3° |
| C20 | C19 | C18 | H191 | 120.4° | 123.3° |
| C20 | C19 | C18 | C17 | 172.5° | 177.5° |
| C20 | C19 | C18 | H182 | 67.5° | 57.5° |
| C20 | C19 | C18 | H181 | 52.6° | 62.5° |
| C19 | C20 | C25 | H251 | 104.9° | 123.8° |
| C19 | C20 | N21 | H211 | 57.1° | 59.9° |
| N21 | C20 | C19 | C18 | 44.6° | 28.1° |
| N21 | C20 | C19 | H191 | 163.7° | 151.2° |
| N21 | C20 | C25 | H251 | 132.0° | 118.2° |
| C19 | C18 | C17 | H182 | 119.9° | 120.0° |
| C19 | C18 | C17 | H181 | 119.9° | 120.0° |
| C19 | C18 | C17 | C16 | 177.8° | 179.9° |
| C19 | C18 | C17 | H172 | 62.1° | 60.0° |
| C19 | C18 | C17 | H171 | 57.7° | 60.0° |
| C19 | C18 | H182 | H181 | 120.1° | 120.0° |
| C18 | C19 | C20 | H201 | 82.1° | 93.2° |
| C18 | C17 | C16 | H172 | 120.1° | 119.9° |
| C18 | C17 | C16 | H171 | 120.1° | 120.0° |
| C18 | C17 | C16 | C15 | 175.6° | 180.0° |
| C18 | C17 | C16 | H161 | 64.4° | 60.1° |
| C18 | C17 | C16 | H162 | 55.6° | 60.0° |
| C18 | C17 | H172 | H171 | 119.7° | 119.9° |
| C17 | C18 | H182 | H181 | 120.1° | 120.0° |
| C17 | C18 | C19 | H191 | 52.1° | 54.3° |
| C17 | C16 | C15 | H161 | 120.0° | 120.0° |
| C17 | C16 | C15 | H162 | 120.0° | 120.0° |
| C17 | C16 | C15 | C13 | 77.1° | 180.0° |
| C17 | C16 | C15 | H152 | 43.7° | 60.1° |
| C17 | C16 | C15 | H151 | 162.1° | 60.0° |
| C17 | C16 | H161 | H162 | 120.0° | 120.1° |
| C16 | C17 | H172 | H171 | 119.7° | 120.1° |
| C16 | C17 | C18 | H182 | 57.9° | 60.0° |
| C16 | C17 | C18 | H181 | 62.2° | 60.0° |
| C16 | C15 | C13 | H152 | 120.8° | 120.0° |
| C16 | C15 | C13 | H151 | 120.8° | 120.0° |
| C16 | C15 | C13 | N12 | 152.7° | 180.0° |
| C16 | C15 | C13 | O14 | 26.7° | 0.1° |
| C16 | C15 | H152 | H151 | 117.5° | 120.0° |
| C15 | C16 | H161 | H162 | 120.0° | 119.9° |
| C15 | C16 | C17 | H172 | 55.5° | 60.1° |
| C15 | C16 | C17 | H171 | 64.3° | 60.0° |
| C15 | C13 | N12 | O14 | 179.4° | 179.9° |
| C15 | C13 | N12 | C11 | 176.6° | 180.0° |
| C13 | C15 | H152 | H151 | 117.5° | 120.0° |
| C13 | C15 | C16 | H161 | 162.9° | 60.0° |
| C13 | C15 | C16 | H162 | 42.9° | 60.0° |
| C15 | C13 | N12 | H121 | 3.4° | 0.0° |
| N01 | C10 | C11 | H101 | 120.1° | 120.0° |
| N01 | C10 | C11 | H102 | 120.1° | 120.0° |
| N01 | C10 | C11 | N12 | 174.4° | 180.0° |
| C10 | N01 | C02 | H011 | 120.7° | 124.0° |
| C10 | N01 | C02 | C03 | 156.7° | 180.0° |
| C10 | N01 | C02 | H021 | 36.8° | 60.0° |
| C10 | N01 | C02 | H022 | 83.4° | 60.0° |
| N01 | C10 | H101 | H102 | 119.8° | 120.0° |
| N01 | C10 | C11 | H111 | 53.7° | 60.0° |
| N01 | C10 | C11 | H112 | 64.9° | 60.0° |
| C10 | C11 | N12 | C13 | 91.1° | 180.0° |
| C10 | C11 | N12 | H111 | 120.7° | 120.0° |
| C10 | C11 | N12 | H112 | 120.7° | 120.0° |
| C11 | C10 | N01 | C02 | 62.8° | 180.0° |
| C11 | C10 | H101 | H102 | 119.8° | 120.0° |
| C10 | C11 | H111 | H112 | 117.8° | 120.0° |
| C11 | C10 | N01 | H011 | 57.9° | 56.0° |
| C10 | C11 | N12 | H121 | 88.9° | 0.0° |
| C13 | N12 | C11 | H121 | 180.0° | 180.0° |
| C13 | N12 | C11 | H111 | 29.5° | 60.0° |
| C13 | N12 | C11 | H112 | 148.1° | 60.0° |
| N12 | C13 | C15 | H152 | 31.9° | 60.0° |
| N12 | C13 | C15 | H151 | 86.5° | 60.0° |
| C11 | N12 | C13 | O14 | 4.0° | 0.1° |
| N12 | C11 | C10 | H101 | 65.5° | 60.0° |
| N12 | C11 | C10 | H102 | 54.4° | 60.0° |
| N12 | C11 | H111 | H112 | 117.8° | 120.0° |
| O14 | C13 | C15 | H152 | 147.5° | 120.0° |
| O14 | C13 | C15 | H151 | 94.1° | 120.0° |
| O14 | C13 | N12 | H121 | 176.1° | 179.9° |
| N01 | C02 | C03 | N08 | 4.9° | 85.3° |
| N01 | C02 | C03 | H021 | 119.9° | 120.0° |
| N01 | C02 | C03 | H022 | 119.9° | 120.0° |
| N01 | C02 | C03 | C04 | 175.9° | 95.0° |
| N01 | C02 | H021 | H022 | 120.2° | 120.0° |
| C02 | N01 | C10 | H101 | 57.2° | 60.0° |
| C02 | N01 | C10 | H102 | 177.1° | 60.0° |
| C07 | N08 | C03 | C02 | 179.9° | 179.7° |
| N08 | C07 | C06 | H071 | 180.0° | 179.7° |
| C07 | N08 | C03 | C04 | 0.9° | 0.6° |
| N08 | C07 | C06 | C09 | 179.6° | 179.8° |
| N08 | C07 | C06 | C05 | 0.4° | 0.3° |
| N08 | C03 | C02 | C04 | 179.2° | 179.7° |
| C03 | N08 | C07 | C06 | 0.7° | 0.5° |
| N08 | C03 | C04 | C05 | 1.0° | 0.3° |
| N08 | C03 | C02 | H021 | 115.1° | 34.8° |
| N08 | C03 | C02 | H022 | 124.8° | 154.7° |
| N08 | C03 | C04 | H041 | 179.0° | 179.8° |
| C03 | N08 | C07 | H071 | 179.3° | 179.7° |
| C02 | C03 | C04 | C05 | 179.8° | 180.0° |
| C03 | C02 | H021 | H022 | 120.3° | 120.0° |
| C02 | C03 | C04 | H041 | 0.2° | 0.1° |
| C03 | C02 | N01 | H011 | 82.6° | 56.0° |
| C07 | C06 | C09 | C05 | 180.0° | 179.9° |
| C07 | C06 | C05 | C04 | 0.5° | 0.0° |
| C07 | C06 | C05 | H051 | 179.5° | 180.0° |
| C07 | C06 | C09 | H092 | 90.0° | 90.1° |
| C07 | C06 | C09 | H093 | 150.0° | 30.0° |
| C07 | C06 | C09 | H091 | 30.0° | 149.9° |
| C03 | C04 | C05 | C06 | 0.7° | 0.0° |
| C03 | C04 | C05 | H041 | 180.0° | 179.9° |
| C04 | C03 | C02 | H021 | 64.1° | 144.9° |
| C04 | C03 | C02 | H022 | 56.0° | 25.0° |
| C03 | C04 | C05 | H051 | 179.3° | 180.0° |
| C09 | C06 | C05 | C04 | 179.6° | 180.0° |
| C09 | C06 | C05 | H051 | 0.4° | 0.0° |
| C09 | C06 | C07 | H071 | 0.4° | 0.1° |
| C06 | C09 | H092 | H093 | 120.0° | 120.0° |
| C06 | C09 | H092 | H091 | 120.0° | 120.0° |
| C06 | C09 | H093 | H091 | 120.0° | 120.0° |
| C06 | C05 | C04 | H051 | 180.0° | 180.0° |
| C06 | C05 | C04 | H041 | 179.3° | 179.9° |
| C05 | C06 | C07 | H071 | 179.6° | 180.0° |
| C05 | C06 | C09 | H092 | 90.0° | 90.0° |
| C05 | C06 | C09 | H093 | 30.0° | 150.0° |
| C05 | C06 | C09 | H091 | 150.0° | 30.0° |
| H021 | C02 | N01 | H011 | 157.5° | 64.0° |
| H022 | C02 | N01 | H011 | 37.3° | 176.0° |
| H041 | C04 | C05 | H051 | 0.7° | 0.1° |
| H092 | C09 | H093 | H091 | 120.0° | 120.0° |
| H101 | C10 | C11 | H111 | 173.8° | 60.0° |
| H101 | C10 | C11 | H112 | 55.2° | 180.0° |
| H101 | C10 | N01 | H011 | 178.0° | 176.0° |
| H102 | C10 | C11 | H111 | 66.4° | NaN° |
| H102 | C10 | C11 | H112 | 175.1° | 60.0° |
| H102 | C10 | N01 | H011 | 62.2° | 64.0° |
| H111 | C11 | N12 | H121 | 150.4° | 120.0° |
| H112 | C11 | N12 | H121 | 31.8° | 120.0° |
| H152 | C15 | C16 | H161 | 76.3° | 180.0° |
| H152 | C15 | C16 | H162 | 163.7° | 60.0° |
| H151 | C15 | C16 | H161 | 42.1° | 60.0° |
| H151 | C15 | C16 | H162 | 77.9° | 180.0° |
| H161 | C16 | C17 | H172 | 175.5° | 180.0° |
| H161 | C16 | C17 | H171 | 55.7° | 59.9° |
| H162 | C16 | C17 | H172 | 64.5° | 59.9° |
| H162 | C16 | C17 | H171 | 175.7° | 180.0° |
| H172 | C17 | C18 | H182 | 178.0° | 180.0° |
| H172 | C17 | C18 | H181 | 57.9° | 60.0° |
| H171 | C17 | C18 | H182 | 62.2° | 60.0° |
| H171 | C17 | C18 | H181 | 177.6° | 180.0° |
| H182 | C18 | C19 | H191 | 172.1° | 65.7° |
| H181 | C18 | C19 | H191 | 67.8° | 174.3° |
| H191 | C19 | C20 | H201 | 37.1° | 30.0° |
| H201 | C20 | C25 | H251 | 11.9° | 0.1° |
| H201 | C20 | N21 | H211 | 69.1° | 61.4° |
| H251 | C25 | C26 | H262 | 19.3° | 29.7° |
| H251 | C25 | C26 | H261 | 101.1° | 93.6° |
| H251 | C25 | N24 | H241 | 55.3° | 61.9° |






