K6V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C03 | sing | 1.53Å | 1.53Å | |
| C02 | O01 | sing | 1.43Å | 1.40Å | |
| C03 | C04 | sing | 1.53Å | 1.53Å | |
| C03 | N05 | sing | 1.47Å | 1.44Å | |
| O07 | C06 | doub | 1.21Å | 1.18Å | |
| C06 | N05 | sing | 1.35Å | 1.45Å | |
| C06 | C08 | sing | 1.51Å | 1.52Å | |
| C08 | C09 | sing | 1.53Å | 1.52Å | |
| C09 | C10 | sing | 1.53Å | 1.52Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | 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 | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H103 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| O01 | H011 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C03 | C02 | O01 | 110.9° | 109.5° |
| C02 | C03 | C04 | 111.5° | 109.5° |
| C02 | C03 | N05 | 105.9° | 109.4° |
| C03 | C02 | H021 | 109.1° | 109.5° |
| C03 | C02 | H022 | 109.1° | 109.4° |
| C02 | C03 | H031 | 108.6° | 109.5° |
| O01 | C02 | H021 | 109.1° | 109.5° |
| O01 | C02 | H022 | 109.1° | 109.4° |
| C02 | O01 | H011 | 109.5° | 114.0° |
| C04 | C03 | N05 | 112.5° | 109.4° |
| C04 | C03 | H031 | 108.6° | 109.5° |
| C03 | C04 | H043 | 109.5° | 109.5° |
| C03 | C04 | H041 | 109.4° | 109.4° |
| C03 | C04 | H042 | 109.5° | 109.5° |
| C03 | N05 | C06 | 118.4° | 120.0° |
| N05 | C03 | H031 | 109.8° | 109.5° |
| C03 | N05 | H051 | 120.8° | 120.0° |
| O07 | C06 | N05 | 121.5° | 120.0° |
| O07 | C06 | C08 | 121.4° | 120.0° |
| N05 | C06 | C08 | 117.2° | 120.0° |
| C06 | N05 | H051 | 120.8° | 120.0° |
| C06 | C08 | C09 | 107.5° | 109.5° |
| C06 | C08 | H082 | 110.0° | 109.5° |
| C06 | C08 | H081 | 109.9° | 109.5° |
| C08 | C09 | C10 | 109.5° | 109.5° |
| C09 | C08 | H082 | 109.9° | 109.5° |
| C09 | C08 | H081 | 110.0° | 109.5° |
| C08 | C09 | H091 | 109.5° | 109.5° |
| C08 | C09 | H092 | 109.5° | 109.5° |
| C10 | C09 | H091 | 109.5° | 109.5° |
| C10 | C09 | H092 | 109.5° | 109.4° |
| C09 | C10 | H102 | 109.5° | 109.5° |
| C09 | C10 | H101 | 109.5° | 109.4° |
| C09 | C10 | H103 | 109.5° | 109.5° |
| H021 | C02 | H022 | 109.5° | 109.5° |
| H043 | C04 | H041 | 109.5° | 109.4° |
| H043 | C04 | H042 | 109.5° | 109.5° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H082 | C08 | H081 | 109.5° | 109.5° |
| H091 | C09 | H092 | 109.4° | 109.5° |
| H102 | C10 | H101 | 109.5° | 109.5° |
| H102 | C10 | H103 | 109.5° | 109.5° |
| H101 | C10 | H103 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C03 | C02 | O01 | H021 | 120.2° | 120.1° |
| C03 | C02 | O01 | H022 | 120.2° | 119.9° |
| C02 | C03 | C04 | N05 | 118.7° | 119.9° |
| C02 | C03 | C04 | H031 | 119.6° | 120.1° |
| C02 | C03 | N05 | H031 | 117.0° | 120.0° |
| C02 | C03 | N05 | C06 | 90.9° | 155.0° |
| C03 | C02 | H021 | H022 | 119.4° | 119.9° |
| C02 | C03 | C04 | H043 | 180.0° | 59.9° |
| C02 | C03 | C04 | H041 | 60.0° | 60.1° |
| C02 | C03 | C04 | H042 | 60.0° | 180.0° |
| C02 | C03 | N05 | H051 | 89.1° | 24.9° |
| C03 | C02 | O01 | H011 | 180.0° | 180.0° |
| O01 | C02 | C03 | C04 | 92.7° | 54.9° |
| O01 | C02 | C03 | N05 | 29.9° | 65.0° |
| O01 | C02 | H021 | H022 | 119.3° | 120.0° |
| O01 | C02 | C03 | H031 | 147.7° | 175.0° |
| C04 | C03 | N05 | H031 | 121.0° | 120.0° |
| C04 | C03 | N05 | C06 | 147.1° | 85.1° |
| C04 | C03 | C02 | H021 | 147.1° | 175.0° |
| C04 | C03 | C02 | H022 | 27.5° | 65.0° |
| C03 | C04 | H043 | H041 | 120.0° | 119.9° |
| C03 | C04 | H043 | H042 | 120.0° | 120.1° |
| C03 | C04 | H041 | H042 | 120.0° | 120.0° |
| C04 | C03 | N05 | H051 | 32.9° | 95.0° |
| C03 | N05 | C06 | O07 | 0.8° | 0.1° |
| C03 | N05 | C06 | H051 | 180.0° | 179.9° |
| C03 | N05 | C06 | C08 | 179.5° | 180.0° |
| N05 | C03 | C02 | H021 | 90.3° | 55.1° |
| N05 | C03 | C02 | H022 | 150.1° | 175.0° |
| N05 | C03 | C04 | H043 | 61.3° | 60.0° |
| N05 | C03 | C04 | H041 | 58.7° | 180.0° |
| N05 | C03 | C04 | H042 | 178.7° | 60.0° |
| O07 | C06 | N05 | C08 | 179.6° | 179.9° |
| O07 | C06 | C08 | C09 | 90.4° | 0.0° |
| O07 | C06 | C08 | H082 | 29.3° | 120.0° |
| O07 | C06 | C08 | H081 | 149.9° | 120.0° |
| O07 | C06 | N05 | H051 | 179.2° | 180.0° |
| N05 | C06 | C08 | C09 | 89.2° | 179.9° |
| C06 | N05 | C03 | H031 | 26.1° | 35.0° |
| N05 | C06 | C08 | H082 | 151.1° | 60.0° |
| N05 | C06 | C08 | H081 | 30.5° | 59.9° |
| C06 | C08 | C09 | H082 | 119.7° | 120.0° |
| C06 | C08 | C09 | H081 | 119.7° | 120.0° |
| C06 | C08 | C09 | C10 | 171.9° | 180.0° |
| C06 | C08 | H082 | H081 | 120.9° | 120.0° |
| C06 | C08 | C09 | H091 | 68.1° | 60.0° |
| C06 | C08 | C09 | H092 | 51.9° | 60.0° |
| C08 | C06 | N05 | H051 | 0.5° | 0.1° |
| C08 | C09 | C10 | H091 | 120.0° | 120.0° |
| C08 | C09 | C10 | H092 | 120.0° | 120.0° |
| C09 | C08 | H082 | H081 | 120.9° | 120.0° |
| C08 | C09 | H091 | H092 | 120.0° | 120.0° |
| C08 | C09 | C10 | H102 | 180.0° | 60.0° |
| C08 | C09 | C10 | H101 | 60.0° | 60.0° |
| C08 | C09 | C10 | H103 | 60.0° | 180.0° |
| C10 | C09 | C08 | H082 | 52.2° | 60.0° |
| C10 | C09 | C08 | H081 | 68.4° | 60.0° |
| C10 | C09 | H091 | H092 | 120.0° | 120.0° |
| C09 | C10 | H102 | H101 | 120.0° | 120.0° |
| C09 | C10 | H102 | H103 | 120.0° | 120.1° |
| C09 | C10 | H101 | H103 | 120.0° | 120.0° |
| H021 | C02 | C03 | H031 | 27.5° | 64.9° |
| H021 | C02 | O01 | H011 | 59.8° | 59.9° |
| H022 | C02 | C03 | H031 | 92.1° | 55.0° |
| H022 | C02 | O01 | H011 | 59.7° | 60.0° |
| H031 | C03 | C04 | H043 | 60.4° | 179.9° |
| H031 | C03 | C04 | H041 | 179.6° | 60.0° |
| H031 | C03 | C04 | H042 | 59.6° | 60.0° |
| H031 | C03 | N05 | H051 | 153.9° | 144.9° |
| H043 | C04 | H041 | H042 | 120.0° | 120.0° |
| H082 | C08 | C09 | H091 | 172.2° | 180.0° |
| H082 | C08 | C09 | H092 | 67.8° | 60.0° |
| H081 | C08 | C09 | H091 | 51.6° | 60.0° |
| H081 | C08 | C09 | H092 | 171.5° | 180.0° |
| H091 | C09 | C10 | H102 | 60.0° | 180.0° |
| H091 | C09 | C10 | H101 | 180.0° | 60.0° |
| H091 | C09 | C10 | H103 | 60.0° | 59.9° |
| H092 | C09 | C10 | H102 | 60.0° | 60.0° |
| H092 | C09 | C10 | H101 | 60.1° | 180.0° |
| H092 | C09 | C10 | H103 | 180.0° | 60.0° |
| H102 | C10 | H101 | H103 | 120.0° | 120.0° |
