VJM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C05 | O04 | sing | 1.43Å | 1.43Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| C03 | O04 | sing | 1.43Å | 1.43Å | |
| C03 | C02 | sing | 1.53Å | 1.55Å | |
| C06 | N07 | sing | 1.47Å | 1.47Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| C16 | C14 | sing | 1.53Å | 1.52Å | |
| N07 | C02 | sing | 1.47Å | 1.45Å | |
| N07 | C08 | sing | 1.39Å | 1.40Å | |
| C02 | C01 | sing | 1.53Å | 1.56Å | |
| C08 | C13 | doub | 1.40Å | 1.41Å | Aromatic |
| C08 | N09 | sing | 1.33Å | 1.37Å | Aromatic |
| C23 | C24 | doub | 1.34Å | 1.40Å | Aromatic |
| C23 | C22 | sing | 1.46Å | 1.39Å | Aromatic |
| C24 | N25 | sing | 1.37Å | 1.36Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| N09 | C10 | doub | 1.33Å | 1.36Å | Aromatic |
| C12 | C14 | sing | 1.51Å | 1.46Å | |
| C12 | N11 | doub | 1.32Å | 1.33Å | Aromatic |
| C14 | S17 | sing | 1.81Å | 1.85Å | |
| C10 | N11 | sing | 1.33Å | 1.35Å | Aromatic |
| C10 | C21 | sing | 1.48Å | 1.41Å | |
| N25 | C26 | sing | 1.38Å | 1.33Å | Aromatic |
| C22 | C21 | doub | 1.41Å | 1.39Å | Aromatic |
| C22 | C26 | sing | 1.41Å | 1.40Å | Aromatic |
| C21 | C29 | sing | 1.40Å | 1.42Å | Aromatic |
| C26 | N27 | doub | 1.33Å | 1.36Å | Aromatic |
| C20 | S17 | sing | 1.81Å | 1.84Å | |
| S17 | N18 | sing | 1.75Å | 1.63Å | |
| S17 | O19 | sing | 1.66Å | 1.58Å | |
| C29 | C28 | doub | 1.38Å | 1.41Å | Aromatic |
| N27 | C28 | sing | 1.32Å | 1.36Å | Aromatic |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| 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 | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| N18 | H1 | sing | 1.01Å | 1.00Å | |
| N18 | H181 | sing | 1.01Å | 1.00Å | |
| N25 | H251 | sing | 0.97Å | 1.00Å | |
| O19 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O04 | C05 | C06 | 113.7° | 109.3° |
| C05 | O04 | C03 | 115.3° | 113.7° |
| O04 | C05 | H052 | 108.4° | 109.5° |
| O04 | C05 | H051 | 108.4° | 109.5° |
| C05 | C06 | N07 | 117.2° | 109.2° |
| C06 | C05 | H052 | 108.4° | 109.5° |
| C06 | C05 | H051 | 108.4° | 109.5° |
| C05 | C06 | H062 | 107.5° | 109.5° |
| C05 | C06 | H061 | 107.5° | 109.5° |
| O04 | C03 | C02 | 112.1° | 109.2° |
| O04 | C03 | H031 | 108.8° | 109.5° |
| O04 | C03 | H032 | 108.8° | 109.5° |
| C03 | C02 | N07 | 112.2° | 109.2° |
| C03 | C02 | C01 | 108.9° | 109.5° |
| C03 | C02 | H021 | 107.2° | 109.5° |
| C02 | C03 | H031 | 108.8° | 109.5° |
| C02 | C03 | H032 | 108.8° | 109.5° |
| C06 | N07 | C02 | 116.2° | 110.8° |
| C06 | N07 | C08 | 118.0° | 111.0° |
| N07 | C06 | H062 | 107.5° | 109.5° |
| N07 | C06 | H061 | 107.5° | 109.6° |
| C15 | C16 | C14 | 60.0° | 60.0° |
| C16 | C15 | C14 | 59.6° | 60.0° |
| C16 | C15 | H152 | 120.1° | 117.5° |
| C16 | C15 | H151 | 120.1° | 117.5° |
| C15 | C16 | H161 | 120.0° | 117.5° |
| C15 | C16 | H162 | 120.0° | 117.5° |
| C16 | C14 | C15 | 60.4° | 60.0° |
| C16 | C14 | C12 | 121.0° | 117.5° |
| C16 | C14 | S17 | 116.2° | 117.5° |
| C14 | C16 | H161 | 120.0° | 117.5° |
| C14 | C16 | H162 | 120.0° | 117.5° |
| C02 | N07 | C08 | 119.9° | 111.0° |
| N07 | C02 | C01 | 112.8° | 109.5° |
| N07 | C02 | H021 | 108.5° | 109.5° |
| N07 | C08 | C13 | 124.0° | 120.5° |
| N07 | C08 | N09 | 120.0° | 120.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C01 | C02 | H021 | 107.1° | 109.6° |
| C13 | C08 | N09 | 116.0° | 119.0° |
| C08 | C13 | C12 | 119.4° | 118.5° |
| C08 | C13 | H131 | 120.3° | 120.7° |
| C08 | N09 | C10 | 124.7° | 120.6° |
| C24 | C23 | C22 | 106.3° | 106.8° |
| C23 | C24 | N25 | 108.5° | 109.9° |
| C24 | C23 | H231 | 126.8° | 126.6° |
| C23 | C24 | H241 | 125.8° | 125.0° |
| C23 | C22 | C21 | 131.9° | 134.3° |
| C23 | C22 | C26 | 107.0° | 106.3° |
| C22 | C23 | H231 | 126.9° | 126.6° |
| C24 | N25 | C26 | 109.5° | 110.0° |
| N25 | C24 | H241 | 125.8° | 125.1° |
| C24 | N25 | H251 | 125.2° | 125.0° |
| C13 | C12 | C14 | 122.0° | 120.4° |
| C13 | C12 | N11 | 119.2° | 119.3° |
| C12 | C13 | H131 | 120.3° | 120.7° |
| C15 | C14 | C12 | 122.1° | 117.5° |
| C15 | C14 | S17 | 116.0° | 117.5° |
| C14 | C15 | H152 | 120.0° | 117.5° |
| C14 | C15 | H151 | 120.1° | 117.5° |
| N09 | C10 | N11 | 116.8° | 121.6° |
| N09 | C10 | C21 | 123.7° | 119.2° |
| C14 | C12 | N11 | 118.7° | 120.3° |
| C12 | C14 | S17 | 112.1° | 115.6° |
| C12 | N11 | C10 | 123.8° | 120.9° |
| C14 | S17 | C20 | 107.8° | 180.0° |
| C14 | S17 | N18 | 106.4° | 90.0° |
| C14 | S17 | O19 | 108.8° | 90.0° |
| N11 | C10 | C21 | 119.4° | 119.2° |
| C10 | C21 | C22 | 124.3° | 121.2° |
| C10 | C21 | C29 | 119.8° | 121.1° |
| N25 | C26 | C22 | 108.7° | 106.9° |
| N25 | C26 | N27 | 129.2° | 133.2° |
| C26 | N25 | H251 | 125.2° | 125.0° |
| C21 | C22 | C26 | 121.0° | 119.4° |
| C22 | C21 | C29 | 115.8° | 117.8° |
| C22 | C26 | N27 | 122.2° | 119.9° |
| C21 | C29 | C28 | 121.4° | 119.3° |
| C21 | C29 | H291 | 119.3° | 120.3° |
| C26 | N27 | C28 | 119.2° | 122.1° |
| C20 | S17 | N18 | 105.9° | 90.0° |
| C20 | S17 | O19 | 107.5° | 90.0° |
| S17 | C20 | H202 | 109.5° | 109.4° |
| S17 | C20 | H201 | 109.5° | 109.5° |
| S17 | C20 | H203 | 109.5° | 109.5° |
| N18 | S17 | O19 | 119.8° | 120.0° |
| S17 | N18 | H1 | 109.5° | 111.0° |
| S17 | N18 | H181 | 109.5° | 111.0° |
| S17 | O19 | H2 | 109.5° | 113.9° |
| C29 | C28 | N27 | 120.4° | 121.7° |
| C29 | C28 | H281 | 119.8° | 119.1° |
| C28 | C29 | H291 | 119.3° | 120.4° |
| N27 | C28 | H281 | 119.8° | 119.2° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H013 | C01 | H012 | 109.5° | 109.4° |
| H031 | C03 | H032 | 109.5° | 109.6° |
| H052 | C05 | H051 | 109.5° | 109.5° |
| H062 | C06 | H061 | 109.5° | 109.6° |
| H152 | C15 | H151 | 109.5° | 115.6° |
| H161 | C16 | H162 | 109.5° | 115.5° |
| H202 | C20 | H201 | 109.4° | 109.4° |
| H202 | C20 | H203 | 109.4° | 109.5° |
| H201 | C20 | H203 | 109.5° | 109.4° |
| H1 | N18 | H181 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O04 | C05 | C06 | H052 | 120.6° | 120.0° |
| O04 | C05 | C06 | H051 | 120.6° | 119.9° |
| C05 | O04 | C03 | C02 | 55.5° | 58.7° |
| O04 | C05 | C06 | N07 | 32.9° | 56.8° |
| C05 | O04 | C03 | H031 | 64.8° | 178.6° |
| C05 | O04 | C03 | H032 | 175.9° | 61.3° |
| O04 | C05 | H052 | H051 | 118.1° | 120.1° |
| O04 | C05 | C06 | H062 | 88.2° | 63.0° |
| O04 | C05 | C06 | H061 | 154.0° | 176.8° |
| C06 | C05 | O04 | C03 | 44.9° | 58.7° |
| C05 | C06 | N07 | H062 | 121.1° | 119.8° |
| C05 | C06 | N07 | H061 | 121.1° | 120.0° |
| C05 | C06 | N07 | C02 | 33.1° | 58.6° |
| C05 | C06 | N07 | C08 | 173.8° | 177.7° |
| C06 | C05 | H052 | H051 | 118.1° | 120.1° |
| C05 | C06 | H062 | H061 | 116.5° | 120.1° |
| O04 | C03 | C02 | H031 | 120.4° | 119.9° |
| O04 | C03 | C02 | H032 | 120.4° | 120.0° |
| O04 | C03 | C02 | N07 | 53.2° | 56.9° |
| O04 | C03 | C02 | C01 | 72.4° | 63.0° |
| O04 | C03 | C02 | H021 | 172.2° | 176.8° |
| O04 | C03 | H031 | H032 | 118.8° | 120.1° |
| C03 | O04 | C05 | H052 | 165.5° | 61.3° |
| C03 | O04 | C05 | H051 | 75.8° | 178.6° |
| C03 | C02 | N07 | C06 | 42.2° | 58.7° |
| C03 | C02 | N07 | C01 | 123.4° | 119.9° |
| C03 | C02 | N07 | H021 | 118.2° | 119.9° |
| C03 | C02 | N07 | C08 | 165.3° | 177.6° |
| C03 | C02 | C01 | H021 | 115.6° | 120.1° |
| C03 | C02 | C01 | H011 | 180.0° | 59.9° |
| C03 | C02 | C01 | H013 | 60.0° | 179.9° |
| C03 | C02 | C01 | H012 | 60.0° | 60.1° |
| C02 | C03 | H031 | H032 | 118.8° | 120.1° |
| C06 | N07 | C02 | C08 | 152.5° | 123.8° |
| C06 | N07 | C02 | C01 | 81.2° | 61.3° |
| C06 | N07 | C08 | C13 | 7.7° | 56.0° |
| C06 | N07 | C08 | N09 | 172.8° | 123.7° |
| C06 | N07 | C02 | H021 | 160.4° | 178.5° |
| N07 | C06 | C05 | H052 | 153.5° | 63.2° |
| N07 | C06 | C05 | H051 | 87.8° | 176.7° |
| N07 | C06 | H062 | H061 | 116.5° | 120.2° |
| C15 | C16 | C14 | H161 | 109.5° | 107.5° |
| C15 | C16 | C14 | H162 | 109.5° | 107.5° |
| C16 | C15 | C14 | H152 | 109.4° | 107.4° |
| C16 | C15 | C14 | H151 | 109.4° | 107.5° |
| C16 | C15 | C14 | C12 | 110.0° | 107.5° |
| C15 | C16 | C14 | S17 | 106.4° | 107.5° |
| C16 | C15 | H152 | H151 | 145.0° | 145.7° |
| C15 | C16 | H161 | H162 | 144.7° | 145.7° |
| C16 | C14 | C12 | C13 | 72.3° | 151.9° |
| C16 | C14 | C12 | S17 | 143.2° | 145.7° |
| C16 | C14 | C12 | N11 | 107.5° | 28.1° |
| C16 | C14 | S17 | C20 | 64.1° | 93.6° |
| C16 | C14 | S17 | N18 | 49.2° | 74.6° |
| C16 | C14 | S17 | O19 | 179.6° | 45.4° |
| C14 | C16 | H161 | H162 | 144.7° | 145.7° |
| N07 | C02 | C01 | H021 | 119.2° | 120.2° |
| C02 | N07 | C08 | C13 | 159.7° | 179.7° |
| C02 | N07 | C08 | N09 | 20.7° | 0.0° |
| N07 | C02 | C01 | H011 | 54.8° | 59.9° |
| N07 | C02 | C01 | H013 | 174.8° | 60.1° |
| N07 | C02 | C01 | H012 | 65.2° | 179.9° |
| N07 | C02 | C03 | H031 | 67.2° | 176.8° |
| N07 | C02 | C03 | H032 | 173.6° | 63.1° |
| C02 | N07 | C06 | H062 | 88.0° | 61.3° |
| C02 | N07 | C06 | H061 | 154.3° | 178.5° |
| C08 | N07 | C02 | C01 | 71.3° | 62.5° |
| N07 | C08 | C13 | N09 | 179.6° | 179.7° |
| N07 | C08 | C13 | C12 | 179.3° | 179.7° |
| N07 | C08 | N09 | C10 | 179.8° | 179.7° |
| C08 | N07 | C02 | H021 | 47.1° | 57.7° |
| C08 | N07 | C06 | H062 | 65.1° | 62.5° |
| C08 | N07 | C06 | H061 | 52.7° | 57.7° |
| N07 | C08 | C13 | H131 | 0.6° | 0.3° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H013 | H012 | 120.0° | 120.0° |
| C01 | C02 | C03 | H031 | 167.3° | 56.8° |
| C01 | C02 | C03 | H032 | 48.1° | 177.0° |
| C08 | C13 | C12 | H131 | 180.0° | 179.9° |
| C13 | C08 | N09 | C10 | 0.6° | 0.1° |
| C08 | C13 | C12 | C14 | 179.2° | 180.0° |
| C08 | C13 | C12 | N11 | 1.0° | 0.1° |
| N09 | C08 | C13 | C12 | 1.1° | 0.1° |
| C08 | N09 | C10 | N11 | 0.0° | 0.0° |
| C08 | N09 | C10 | C21 | 176.8° | 180.0° |
| N09 | C08 | C13 | H131 | 179.0° | 180.0° |
| C24 | C23 | C22 | H231 | 180.0° | 179.9° |
| C23 | C24 | N25 | H241 | 180.0° | 180.0° |
| C23 | C24 | N25 | C26 | 1.7° | 0.0° |
| C24 | C23 | C22 | C21 | 178.4° | 180.0° |
| C24 | C23 | C22 | C26 | 0.7° | 0.0° |
| C23 | C24 | N25 | H251 | 178.3° | 180.0° |
| C22 | C23 | C24 | N25 | 1.5° | 0.0° |
| C23 | C22 | C21 | C10 | 4.4° | 0.0° |
| C23 | C22 | C26 | N25 | 0.3° | 0.0° |
| C23 | C22 | C21 | C26 | 177.4° | 180.0° |
| C23 | C22 | C21 | C29 | 180.0° | 179.7° |
| C23 | C22 | C26 | N27 | 179.6° | 180.0° |
| C22 | C23 | C24 | H241 | 178.5° | 179.9° |
| C24 | N25 | C26 | H251 | 180.0° | 179.9° |
| C24 | N25 | C26 | C22 | 1.3° | 0.0° |
| C24 | N25 | C26 | N27 | 179.5° | 180.0° |
| N25 | C24 | C23 | H231 | 178.5° | 179.9° |
| C13 | C12 | C14 | C15 | 0.0° | 139.4° |
| C13 | C12 | C14 | N11 | 179.8° | 180.0° |
| C13 | C12 | C14 | S17 | 144.5° | 6.2° |
| C13 | C12 | N11 | C10 | 0.4° | 0.0° |
| C15 | C14 | C12 | S17 | 144.5° | 145.6° |
| C15 | C14 | C12 | N11 | 179.8° | 40.5° |
| C15 | C14 | S17 | C20 | 132.3° | 162.2° |
| C15 | C14 | S17 | N18 | 19.0° | 143.2° |
| C15 | C14 | S17 | O19 | 111.4° | 23.3° |
| C14 | C15 | H152 | H151 | 144.9° | 145.7° |
| N09 | C10 | N11 | C12 | 0.1° | 0.0° |
| N09 | C10 | N11 | C21 | 177.0° | 180.0° |
| N09 | C10 | C21 | C22 | 26.3° | 0.3° |
| N09 | C10 | C21 | C29 | 149.2° | 180.0° |
| C14 | C12 | N11 | C10 | 179.7° | 180.0° |
| C12 | C14 | S17 | C20 | 81.0° | 52.1° |
| C12 | C14 | S17 | N18 | 165.7° | 71.1° |
| C12 | C14 | S17 | O19 | 35.4° | 168.9° |
| C14 | C12 | C13 | H131 | 0.8° | 0.0° |
| C12 | C14 | C15 | H152 | 0.6° | 145.1° |
| C12 | C14 | C15 | H151 | 140.6° | 0.0° |
| C12 | C14 | C16 | H161 | 138.7° | 0.0° |
| C12 | C14 | C16 | H162 | 2.3° | 145.0° |
| N11 | C12 | C14 | S17 | 35.7° | 173.8° |
| C12 | N11 | C10 | C21 | 177.1° | 180.0° |
| N11 | C12 | C13 | H131 | 179.0° | 180.0° |
| C14 | S17 | C20 | N18 | 113.6° | 19.0° |
| C14 | S17 | C20 | O19 | 117.2° | 139.0° |
| C14 | S17 | N18 | O19 | 123.8° | 90.0° |
| S17 | C14 | C15 | H152 | 143.9° | 0.1° |
| S17 | C14 | C15 | H151 | 2.6° | 145.0° |
| S17 | C14 | C16 | H161 | 3.1° | 145.0° |
| S17 | C14 | C16 | H162 | 144.1° | 0.0° |
| C14 | S17 | C20 | H202 | 180.0° | 161.0° |
| C14 | S17 | C20 | H201 | 60.0° | 79.0° |
| C14 | S17 | C20 | H203 | 60.0° | 41.0° |
| C14 | S17 | N18 | H1 | 180.0° | 47.3° |
| C14 | S17 | N18 | H181 | 60.0° | 76.6° |
| C14 | S17 | O19 | H2 | 180.0° | 90.0° |
| N11 | C10 | C21 | C22 | 156.9° | 179.7° |
| N11 | C10 | C21 | C29 | 27.6° | 0.0° |
| C10 | C21 | C22 | C29 | 175.7° | 179.8° |
| C10 | C21 | C22 | C26 | 178.3° | 180.0° |
| C10 | C21 | C29 | C28 | 178.2° | 180.0° |
| C10 | C21 | C29 | H291 | 1.8° | 0.0° |
| N25 | C26 | C22 | C21 | 177.6° | 180.0° |
| N25 | C26 | C22 | N27 | 179.3° | 180.0° |
| N25 | C26 | N27 | C28 | 179.0° | 179.7° |
| C26 | N25 | C24 | H241 | 178.3° | 179.9° |
| C21 | C22 | C26 | N27 | 1.6° | 0.0° |
| C22 | C21 | C29 | C28 | 2.4° | 0.2° |
| C21 | C22 | C23 | H231 | 1.6° | 0.1° |
| C22 | C21 | C29 | H291 | 177.7° | 179.7° |
| C26 | C22 | C21 | C29 | 2.6° | 0.3° |
| C22 | C26 | N27 | C28 | 0.1° | 0.3° |
| C26 | C22 | C23 | H231 | 179.3° | 179.9° |
| C22 | C26 | N25 | H251 | 178.8° | 180.0° |
| C21 | C29 | C28 | H291 | 180.0° | 179.9° |
| C21 | C29 | C28 | N27 | 1.0° | 0.1° |
| C21 | C29 | C28 | H281 | 179.0° | 180.0° |
| C26 | N27 | C28 | C29 | 0.1° | 0.3° |
| C26 | N27 | C28 | H281 | 179.9° | 179.7° |
| N27 | C26 | N25 | H251 | 0.4° | 0.1° |
| C20 | S17 | N18 | O19 | 121.6° | 90.0° |
| S17 | C20 | H202 | H201 | 120.0° | 120.0° |
| S17 | C20 | H202 | H203 | 120.0° | 120.1° |
| S17 | C20 | H201 | H203 | 120.0° | 120.0° |
| C20 | S17 | N18 | H1 | 65.4° | 132.8° |
| C20 | S17 | N18 | H181 | 174.6° | 103.4° |
| C20 | S17 | O19 | H2 | 63.5° | 90.1° |
| N18 | S17 | C20 | H202 | 66.4° | 180.0° |
| N18 | S17 | C20 | H201 | 53.6° | 60.0° |
| N18 | S17 | C20 | H203 | 173.6° | 60.0° |
| S17 | N18 | H1 | H181 | 120.0° | 123.9° |
| N18 | S17 | O19 | H2 | 57.4° | 180.0° |
| O19 | S17 | C20 | H202 | 62.8° | 60.0° |
| O19 | S17 | C20 | H201 | 177.2° | 60.0° |
| O19 | S17 | C20 | H203 | 57.2° | 180.0° |
| O19 | S17 | N18 | H1 | 56.2° | 42.8° |
| O19 | S17 | N18 | H181 | 63.8° | 166.7° |
| C29 | C28 | N27 | H281 | 180.0° | 180.0° |
| N27 | C28 | C29 | H291 | 179.0° | 180.0° |
| H011 | C01 | H013 | H012 | 120.0° | 119.9° |
| H011 | C01 | C02 | H021 | 64.4° | 180.0° |
| H013 | C01 | C02 | H021 | 55.6° | 60.0° |
| H012 | C01 | C02 | H021 | 175.5° | 59.9° |
| H021 | C02 | C03 | H031 | 51.8° | 63.3° |
| H021 | C02 | C03 | H032 | 67.4° | 56.9° |
| H052 | C05 | C06 | H062 | 32.4° | 177.0° |
| H052 | C05 | C06 | H061 | 85.4° | 56.8° |
| H051 | C05 | C06 | H062 | 151.1° | 56.9° |
| H051 | C05 | C06 | H061 | 33.4° | 63.3° |
| H152 | C15 | C16 | H161 | 141.2° | 145.0° |
| H152 | C15 | C16 | H162 | 0.2° | 0.0° |
| H151 | C15 | C16 | H161 | 0.1° | 0.0° |
| H151 | C15 | C16 | H162 | 141.2° | 145.0° |
| H202 | C20 | H201 | H203 | 119.9° | 120.0° |
| H231 | C23 | C24 | H241 | 1.5° | 0.0° |
| H241 | C24 | N25 | H251 | 1.7° | 0.0° |
| H281 | C28 | C29 | H291 | 1.0° | 0.0° |
