RV8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | O21 | sing | 1.43Å | 1.45Å | |
| C20 | C19 | sing | 1.53Å | 1.44Å | |
| O21 | C19 | sing | 1.43Å | 1.45Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C18 | N17 | sing | 1.46Å | 1.48Å | |
| O16 | C15 | doub | 1.22Å | 1.19Å | |
| C15 | N17 | sing | 1.35Å | 1.46Å | |
| C15 | N10 | sing | 1.35Å | 1.46Å | |
| N17 | C02 | sing | 1.35Å | 1.46Å | |
| C11 | N10 | sing | 1.47Å | 1.48Å | |
| C11 | C12 | sing | 1.53Å | 1.55Å | |
| N10 | C08 | sing | 1.35Å | 1.46Å | |
| C02 | O01 | doub | 1.22Å | 1.19Å | |
| C02 | N03 | sing | 1.35Å | 1.46Å | |
| O07 | C05 | sing | 1.43Å | 1.44Å | |
| O07 | C06 | sing | 1.43Å | 1.45Å | |
| C08 | N03 | sing | 1.35Å | 1.47Å | |
| C08 | O09 | doub | 1.21Å | 1.20Å | |
| N03 | C04 | sing | 1.46Å | 1.48Å | |
| C12 | C13 | sing | 1.53Å | 1.44Å | |
| C12 | O14 | sing | 1.43Å | 1.45Å | |
| C13 | O14 | sing | 1.43Å | 1.45Å | |
| C05 | C04 | sing | 1.53Å | 1.54Å | |
| C05 | C06 | sing | 1.53Å | 1.44Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | 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 | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | 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 |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O21 | C20 | C19 | 60.0° | 57.6° |
| C20 | O21 | C19 | 59.9° | 64.7° |
| O21 | C20 | H201 | 120.0° | 117.8° |
| O21 | C20 | H202 | 120.0° | 117.7° |
| C20 | C19 | O21 | 60.1° | 57.7° |
| C20 | C19 | C18 | 113.3° | 117.8° |
| C20 | C19 | H191 | 118.6° | 117.8° |
| C19 | C20 | H201 | 120.0° | 117.8° |
| C19 | C20 | H202 | 120.0° | 117.8° |
| O21 | C19 | C18 | 117.4° | 117.7° |
| O21 | C19 | H191 | 118.6° | 117.8° |
| C19 | C18 | N17 | 112.4° | 109.5° |
| C19 | C18 | H182 | 108.7° | 109.5° |
| C19 | C18 | H181 | 108.7° | 109.4° |
| C18 | C19 | H191 | 116.6° | 115.7° |
| C18 | N17 | C15 | 120.8° | 120.0° |
| C18 | N17 | C02 | 119.2° | 120.0° |
| N17 | C18 | H182 | 108.7° | 109.5° |
| N17 | C18 | H181 | 108.8° | 109.5° |
| O16 | C15 | N17 | 120.0° | 120.0° |
| O16 | C15 | N10 | 120.2° | 120.0° |
| N17 | C15 | N10 | 119.8° | 120.0° |
| C15 | N17 | C02 | 120.0° | 120.0° |
| C15 | N10 | C11 | 120.2° | 120.0° |
| C15 | N10 | C08 | 120.4° | 120.0° |
| N17 | C02 | O01 | 120.0° | 120.0° |
| N17 | C02 | N03 | 120.2° | 120.0° |
| N10 | C11 | C12 | 109.0° | 109.5° |
| C11 | N10 | C08 | 119.4° | 120.0° |
| N10 | C11 | H112 | 109.6° | 109.4° |
| N10 | C11 | H111 | 109.6° | 109.4° |
| C11 | C12 | C13 | 115.5° | 117.7° |
| C11 | C12 | O14 | 117.0° | 117.7° |
| C12 | C11 | H112 | 109.6° | 109.5° |
| C12 | C11 | H111 | 109.6° | 109.5° |
| C11 | C12 | H121 | 116.2° | 115.7° |
| N10 | C08 | N03 | 119.5° | 120.0° |
| N10 | C08 | O09 | 120.0° | 120.0° |
| O01 | C02 | N03 | 119.9° | 120.0° |
| C02 | N03 | C08 | 120.1° | 120.0° |
| C02 | N03 | C04 | 119.7° | 120.0° |
| C05 | O07 | C06 | 59.8° | 64.8° |
| O07 | C05 | C04 | 116.3° | 117.8° |
| O07 | C05 | C06 | 60.3° | 57.6° |
| O07 | C05 | H051 | 118.8° | 117.8° |
| O07 | C06 | C05 | 59.9° | 57.6° |
| O07 | C06 | H062 | 120.0° | 117.8° |
| O07 | C06 | H061 | 120.0° | 117.8° |
| N03 | C08 | O09 | 120.4° | 120.0° |
| C08 | N03 | C04 | 120.2° | 120.0° |
| N03 | C04 | C05 | 110.8° | 109.5° |
| N03 | C04 | H041 | 109.1° | 109.5° |
| N03 | C04 | H042 | 109.1° | 109.5° |
| C13 | C12 | O14 | 60.0° | 57.7° |
| C12 | C13 | O14 | 60.1° | 57.6° |
| C13 | C12 | H121 | 118.3° | 117.8° |
| C12 | C13 | H131 | 120.0° | 117.7° |
| C12 | C13 | H132 | 120.0° | 117.8° |
| C12 | O14 | C13 | 59.8° | 64.7° |
| O14 | C12 | H121 | 118.2° | 117.9° |
| O14 | C13 | H131 | 120.0° | 117.7° |
| O14 | C13 | H132 | 119.9° | 117.8° |
| C04 | C05 | C06 | 113.5° | 117.8° |
| C05 | C04 | H041 | 109.2° | 109.4° |
| C05 | C04 | H042 | 109.2° | 109.5° |
| C04 | C05 | H051 | 116.9° | 115.7° |
| C06 | C05 | H051 | 118.9° | 117.7° |
| C05 | C06 | H062 | 120.0° | 117.8° |
| C05 | C06 | H061 | 120.0° | 117.8° |
| H112 | C11 | H111 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.5° | 115.8° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H201 | C20 | H202 | 109.5° | 115.7° |
| H041 | C04 | H042 | 109.5° | 109.4° |
| H062 | C06 | H061 | 109.5° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O21 | C20 | C19 | H201 | 109.5° | 106.9° |
| O21 | C20 | C19 | H202 | 109.4° | 106.8° |
| O21 | C20 | C19 | C18 | 109.3° | 106.8° |
| O21 | C20 | C19 | H191 | 108.4° | 106.9° |
| O21 | C20 | H201 | H202 | 144.7° | 146.9° |
| C20 | C19 | C18 | H191 | 143.1° | 147.0° |
| C20 | C19 | C18 | N17 | 169.4° | 178.6° |
| C20 | C19 | C18 | H182 | 49.0° | 58.6° |
| C20 | C19 | C18 | H181 | 70.1° | 61.4° |
| C19 | C20 | H201 | H202 | 144.7° | 147.1° |
| O21 | C19 | C18 | H191 | 149.7° | 146.9° |
| O21 | C19 | C18 | N17 | 102.3° | 112.5° |
| O21 | C19 | C18 | H182 | 18.2° | 7.5° |
| O21 | C19 | C18 | H181 | 137.3° | 127.5° |
| C19 | C18 | N17 | H182 | 120.4° | 120.0° |
| C19 | C18 | N17 | H181 | 120.4° | 120.0° |
| C19 | C18 | N17 | C15 | 67.0° | 90.0° |
| C19 | C18 | N17 | C02 | 114.1° | 89.5° |
| C19 | C18 | H182 | H181 | 118.6° | 120.0° |
| C18 | C19 | C20 | H201 | 0.2° | 146.3° |
| C18 | C19 | C20 | H202 | 141.3° | 0.0° |
| C18 | N17 | C15 | O16 | 0.6° | 0.1° |
| C18 | N17 | C15 | C02 | 178.9° | 179.5° |
| C18 | N17 | C15 | N10 | 179.5° | 179.9° |
| C18 | N17 | C02 | O01 | 0.7° | 0.2° |
| C18 | N17 | C02 | N03 | 179.7° | 179.8° |
| N17 | C18 | H182 | H181 | 118.7° | 120.0° |
| N17 | C18 | C19 | H191 | 47.5° | 34.4° |
| O16 | C15 | N17 | N10 | 179.8° | 179.9° |
| O16 | C15 | N17 | C02 | 179.5° | 179.5° |
| O16 | C15 | N10 | C11 | 0.5° | 0.2° |
| O16 | C15 | N10 | C08 | 179.9° | 180.0° |
| N17 | C15 | N10 | C11 | 179.7° | 179.7° |
| N17 | C15 | N10 | C08 | 0.3° | 0.1° |
| C15 | N17 | C02 | O01 | 179.6° | 179.7° |
| C15 | N17 | C02 | N03 | 0.8° | 0.8° |
| C15 | N17 | C18 | H182 | 53.4° | 30.0° |
| C15 | N17 | C18 | H181 | 172.6° | 150.0° |
| N10 | C15 | N17 | C02 | 0.7° | 0.6° |
| C15 | N10 | C11 | C08 | 179.4° | 179.8° |
| C15 | N10 | C11 | C12 | 118.2° | 90.2° |
| C15 | N10 | C08 | N03 | 0.0° | 0.2° |
| C15 | N10 | C08 | O09 | 179.6° | 179.8° |
| C15 | N10 | C11 | H112 | 121.9° | 29.8° |
| C15 | N10 | C11 | H111 | 1.7° | 149.8° |
| N17 | C02 | O01 | N03 | 179.7° | 179.5° |
| N17 | C02 | N03 | C08 | 0.5° | 0.5° |
| N17 | C02 | N03 | C04 | 179.9° | 180.0° |
| C02 | N17 | C18 | H182 | 125.5° | 150.5° |
| C02 | N17 | C18 | H181 | 6.3° | 30.5° |
| N10 | C11 | C12 | H112 | 119.9° | 119.9° |
| N10 | C11 | C12 | H111 | 119.9° | 120.0° |
| C11 | N10 | C08 | N03 | 179.4° | 180.0° |
| C11 | N10 | C08 | O09 | 0.1° | 0.0° |
| N10 | C11 | C12 | C13 | 75.1° | 180.0° |
| N10 | C11 | C12 | O14 | 7.3° | 114.0° |
| N10 | C11 | H112 | H111 | 120.2° | 120.0° |
| N10 | C11 | C12 | H121 | 139.9° | 33.1° |
| C12 | C11 | N10 | C08 | 61.2° | 90.0° |
| C11 | C12 | C13 | O14 | 107.8° | 106.8° |
| C11 | C12 | C13 | H121 | 144.3° | 146.2° |
| C11 | C12 | O14 | H121 | 146.5° | 146.4° |
| C12 | C11 | H112 | H111 | 120.2° | 120.1° |
| C11 | C12 | C13 | H131 | 142.7° | 146.4° |
| C11 | C12 | C13 | H132 | 1.7° | 0.0° |
| N10 | C08 | N03 | C02 | 0.1° | 0.0° |
| N10 | C08 | N03 | O09 | 179.6° | 180.0° |
| N10 | C08 | N03 | C04 | 179.5° | 179.5° |
| C08 | N10 | C11 | H112 | 58.7° | 150.0° |
| C08 | N10 | C11 | H111 | 178.8° | 30.0° |
| O01 | C02 | N03 | C08 | 179.9° | 180.0° |
| O01 | C02 | N03 | C04 | 0.4° | 0.5° |
| C02 | N03 | C08 | C04 | 179.4° | 179.5° |
| C02 | N03 | C08 | O09 | 179.5° | 180.0° |
| C02 | N03 | C04 | C05 | 91.1° | 90.0° |
| C02 | N03 | C04 | H041 | 148.7° | 30.0° |
| C02 | N03 | C04 | H042 | 29.1° | 150.0° |
| O07 | C05 | C04 | N03 | 89.3° | 114.0° |
| O07 | C05 | C04 | C06 | 67.2° | 66.0° |
| O07 | C05 | C04 | H051 | 148.5° | 147.1° |
| O07 | C05 | C06 | H051 | 108.6° | 106.9° |
| O07 | C05 | C04 | H041 | 150.5° | 6.0° |
| O07 | C05 | C04 | H042 | 30.9° | 126.0° |
| C05 | O07 | C06 | H062 | 109.4° | 106.8° |
| C05 | O07 | C06 | H061 | 109.5° | 106.8° |
| O07 | C06 | H062 | H061 | 144.8° | 147.1° |
| C08 | N03 | C04 | C05 | 89.4° | 89.5° |
| C08 | N03 | C04 | H041 | 30.8° | 150.5° |
| C08 | N03 | C04 | H042 | 150.4° | 30.5° |
| O09 | C08 | N03 | C04 | 0.0° | 0.5° |
| N03 | C04 | C05 | H041 | 120.2° | 120.0° |
| N03 | C04 | C05 | H042 | 120.2° | 120.0° |
| N03 | C04 | C05 | C06 | 156.5° | 180.0° |
| N03 | C04 | H041 | H042 | 119.4° | 120.0° |
| N03 | C04 | C05 | H051 | 59.2° | 33.1° |
| C13 | C12 | O14 | H121 | 108.1° | 106.8° |
| C12 | C13 | O14 | H131 | 109.5° | 106.8° |
| C12 | C13 | O14 | H132 | 109.5° | 106.9° |
| C13 | C12 | C11 | H112 | 165.0° | 60.0° |
| C13 | C12 | C11 | H111 | 44.9° | 60.1° |
| C12 | C13 | H131 | H132 | 144.7° | 147.1° |
| O14 | C12 | C11 | H112 | 127.2° | 126.0° |
| O14 | C12 | C11 | H111 | 112.7° | 6.0° |
| O14 | C13 | H131 | H132 | 144.7° | 147.0° |
| C04 | C05 | C06 | H051 | 143.5° | 146.3° |
| C05 | C04 | H041 | H042 | 119.4° | 120.0° |
| C04 | C05 | C06 | H062 | 1.6° | 146.3° |
| C04 | C05 | C06 | H061 | 142.7° | 0.1° |
| C06 | C05 | C04 | H041 | 83.3° | 60.0° |
| C06 | C05 | C04 | H042 | 36.3° | 60.0° |
| C05 | C06 | H062 | H061 | 144.8° | 146.9° |
| H112 | C11 | C12 | H121 | 20.0° | 86.9° |
| H111 | C11 | C12 | H121 | 100.1° | 153.0° |
| H121 | C12 | C13 | H131 | 1.6° | 0.1° |
| H121 | C12 | C13 | H132 | 142.5° | 146.2° |
| H182 | C18 | C19 | H191 | 167.9° | 154.4° |
| H181 | C18 | C19 | H191 | 73.0° | 85.6° |
| H191 | C19 | C20 | H201 | 142.1° | 0.0° |
| H191 | C19 | C20 | H202 | 1.1° | 146.3° |
| H041 | C04 | C05 | H051 | 60.9° | 153.1° |
| H042 | C04 | C05 | H051 | 179.5° | 87.0° |
| H051 | C05 | C06 | H062 | 141.9° | 0.0° |
| H051 | C05 | C06 | H061 | 0.8° | 146.2° |
