NT8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C10 | sing | 1.53Å | 1.51Å | |
| C10 | C09 | sing | 1.53Å | 1.51Å | |
| C09 | C08 | sing | 1.53Å | 1.51Å | |
| C08 | C07 | sing | 1.53Å | 1.51Å | |
| C07 | C06 | sing | 1.53Å | 1.51Å | |
| C06 | C05 | sing | 1.53Å | 1.51Å | |
| C05 | C04 | sing | 1.53Å | 1.51Å | |
| C04 | C03 | sing | 1.53Å | 1.51Å | |
| C03 | C02 | sing | 1.53Å | 1.51Å | |
| O13 | P12 | doub | 1.48Å | 1.51Å | |
| O15 | P12 | sing | 1.61Å | 1.51Å | |
| C02 | P12 | sing | 1.82Å | 1.81Å | |
| C02 | N01 | sing | 1.47Å | 1.42Å | |
| C02 | P16 | sing | 1.82Å | 1.82Å | |
| P12 | O14 | sing | 1.61Å | 1.51Å | |
| O19 | P16 | doub | 1.48Å | 1.51Å | |
| P16 | O18 | sing | 1.61Å | 1.51Å | |
| P16 | O17 | sing | 1.61Å | 1.51Å | |
| N01 | H011 | sing | 1.01Å | 1.00Å | |
| N01 | H012 | sing | 1.01Å | 1.00Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | 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 | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H113 | sing | 1.09Å | 1.10Å | |
| O14 | H2 | sing | 0.97Å | 0.95Å | |
| O15 | H3 | sing | 0.97Å | 0.95Å | |
| O17 | H4 | sing | 0.97Å | 0.95Å | |
| O18 | H5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C09 | 111.8° | 109.5° |
| C11 | C10 | H101 | 108.9° | 109.5° |
| C11 | C10 | H102 | 108.9° | 109.5° |
| C10 | C11 | H112 | 109.5° | 109.5° |
| C10 | C11 | H111 | 109.5° | 109.5° |
| C10 | C11 | H113 | 109.5° | 109.5° |
| C10 | C09 | C08 | 112.0° | 109.5° |
| C10 | C09 | H091 | 108.9° | 109.5° |
| C10 | C09 | H092 | 108.8° | 109.5° |
| C09 | C10 | H101 | 108.9° | 109.5° |
| C09 | C10 | H102 | 108.9° | 109.5° |
| C09 | C08 | C07 | 111.9° | 109.5° |
| C09 | C08 | H081 | 108.9° | 109.5° |
| C09 | C08 | H082 | 108.9° | 109.5° |
| C08 | C09 | H091 | 108.8° | 109.5° |
| C08 | C09 | H092 | 108.9° | 109.5° |
| C08 | C07 | C06 | 111.9° | 109.5° |
| C08 | C07 | H071 | 108.9° | 109.4° |
| C08 | C07 | H072 | 108.9° | 109.5° |
| C07 | C08 | H081 | 108.9° | 109.4° |
| C07 | C08 | H082 | 108.8° | 109.5° |
| C07 | C06 | C05 | 112.0° | 109.4° |
| C07 | C06 | H061 | 108.8° | 109.4° |
| C07 | C06 | H062 | 108.8° | 109.5° |
| C06 | C07 | H071 | 108.9° | 109.5° |
| C06 | C07 | H072 | 108.9° | 109.5° |
| C06 | C05 | C04 | 112.0° | 109.5° |
| C06 | C05 | H051 | 108.8° | 109.5° |
| C06 | C05 | H052 | 108.8° | 109.5° |
| C05 | C06 | H061 | 108.8° | 109.5° |
| C05 | C06 | H062 | 108.8° | 109.5° |
| C05 | C04 | C03 | 111.5° | 109.5° |
| C05 | C04 | H041 | 109.0° | 109.5° |
| C05 | C04 | H042 | 109.0° | 109.5° |
| C04 | C05 | H051 | 108.9° | 109.5° |
| C04 | C05 | H052 | 108.8° | 109.5° |
| C04 | C03 | C02 | 113.3° | 109.5° |
| C04 | C03 | H032 | 108.5° | 109.5° |
| C04 | C03 | H031 | 108.5° | 109.5° |
| C03 | C04 | H041 | 109.0° | 109.5° |
| C03 | C04 | H042 | 109.0° | 109.5° |
| C03 | C02 | P12 | 109.5° | 109.5° |
| C03 | C02 | N01 | 110.4° | 109.5° |
| C03 | C02 | P16 | 108.8° | 109.4° |
| C02 | C03 | H032 | 108.5° | 109.4° |
| C02 | C03 | H031 | 108.5° | 109.4° |
| O13 | P12 | O15 | 109.7° | 109.5° |
| O13 | P12 | C02 | 109.5° | 109.5° |
| O13 | P12 | O14 | 109.1° | 109.5° |
| O15 | P12 | C02 | 109.4° | 109.4° |
| O15 | P12 | O14 | 109.7° | 109.5° |
| P12 | O15 | H3 | 109.5° | 114.0° |
| P12 | C02 | N01 | 109.9° | 109.5° |
| P12 | C02 | P16 | 108.6° | 109.5° |
| C02 | P12 | O14 | 109.4° | 109.5° |
| N01 | C02 | P16 | 109.7° | 109.5° |
| C02 | N01 | H011 | 109.5° | 111.0° |
| C02 | N01 | H012 | 109.4° | 111.0° |
| C02 | P16 | O19 | 109.6° | 109.5° |
| C02 | P16 | O18 | 109.1° | 109.5° |
| C02 | P16 | O17 | 109.2° | 109.5° |
| P12 | O14 | H2 | 109.5° | 114.0° |
| O19 | P16 | O18 | 109.5° | 109.4° |
| O19 | P16 | O17 | 109.8° | 109.5° |
| O18 | P16 | O17 | 109.6° | 109.5° |
| P16 | O18 | H5 | 109.5° | 114.0° |
| P16 | O17 | H4 | 109.5° | 114.0° |
| H011 | N01 | H012 | 109.5° | 111.0° |
| H032 | C03 | H031 | 109.4° | 109.5° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H051 | C05 | H052 | 109.5° | 109.5° |
| H061 | C06 | H062 | 109.4° | 109.5° |
| H071 | C07 | H072 | 109.5° | 109.5° |
| H081 | C08 | H082 | 109.4° | 109.5° |
| H091 | C09 | H092 | 109.4° | 109.5° |
| H101 | C10 | H102 | 109.5° | 109.5° |
| H112 | C11 | H111 | 109.4° | 109.5° |
| H112 | C11 | H113 | 109.5° | 109.4° |
| H111 | C11 | H113 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C09 | H101 | 120.3° | 120.0° |
| C11 | C10 | C09 | H102 | 120.3° | 120.0° |
| C11 | C10 | C09 | C08 | 101.0° | 180.0° |
| C11 | C10 | C09 | H091 | 138.6° | 60.0° |
| C11 | C10 | C09 | H092 | 19.4° | 60.0° |
| C11 | C10 | H101 | H102 | 118.9° | 120.0° |
| C10 | C11 | H112 | H111 | 120.0° | 120.0° |
| C10 | C11 | H112 | H113 | 120.0° | 120.0° |
| C10 | C11 | H111 | H113 | 120.0° | 120.0° |
| C10 | C09 | C08 | H091 | 120.4° | 120.0° |
| C10 | C09 | C08 | H092 | 120.4° | 120.0° |
| C10 | C09 | C08 | C07 | 174.9° | 180.0° |
| C10 | C09 | C08 | H081 | 54.5° | 60.0° |
| C10 | C09 | C08 | H082 | 64.7° | 60.0° |
| C10 | C09 | H091 | H092 | 118.8° | 120.0° |
| C09 | C10 | H101 | H102 | 118.9° | 120.0° |
| C09 | C10 | C11 | H112 | 180.0° | 180.0° |
| C09 | C10 | C11 | H111 | 60.0° | 60.0° |
| C09 | C10 | C11 | H113 | 60.0° | 60.0° |
| C09 | C08 | C07 | H081 | 120.4° | 120.0° |
| C09 | C08 | C07 | H082 | 120.4° | 120.0° |
| C09 | C08 | C07 | C06 | 114.8° | 180.0° |
| C09 | C08 | C07 | H071 | 5.5° | 60.0° |
| C09 | C08 | C07 | H072 | 124.8° | 60.0° |
| C09 | C08 | H081 | H082 | 118.9° | 120.0° |
| C08 | C09 | H091 | H092 | 118.9° | 120.0° |
| C08 | C09 | C10 | H101 | 19.4° | 60.0° |
| C08 | C09 | C10 | H102 | 138.7° | 60.0° |
| C08 | C07 | C06 | H071 | 120.4° | 119.9° |
| C08 | C07 | C06 | H072 | 120.4° | 120.0° |
| C08 | C07 | C06 | C05 | 168.9° | 180.0° |
| C08 | C07 | C06 | H061 | 48.5° | 60.0° |
| C08 | C07 | C06 | H062 | 70.7° | 60.0° |
| C08 | C07 | H071 | H072 | 118.9° | 120.0° |
| C07 | C08 | H081 | H082 | 118.8° | 120.0° |
| C07 | C08 | C09 | H091 | 64.7° | 60.0° |
| C07 | C08 | C09 | H092 | 54.5° | 60.0° |
| C07 | C06 | C05 | H061 | 120.4° | 120.0° |
| C07 | C06 | C05 | H062 | 120.4° | 120.0° |
| C07 | C06 | C05 | C04 | 177.5° | 180.0° |
| C07 | C06 | C05 | H051 | 57.1° | 60.0° |
| C07 | C06 | C05 | H052 | 62.2° | 60.0° |
| C07 | C06 | H061 | H062 | 118.8° | 120.0° |
| C06 | C07 | H071 | H072 | 118.9° | 120.1° |
| C06 | C07 | C08 | H081 | 124.8° | 60.0° |
| C06 | C07 | C08 | H082 | 5.6° | 60.0° |
| C06 | C05 | C04 | H051 | 120.4° | 120.0° |
| C06 | C05 | C04 | H052 | 120.4° | 120.0° |
| C06 | C05 | C04 | C03 | 151.7° | 180.0° |
| C06 | C05 | C04 | H041 | 31.4° | 60.0° |
| C06 | C05 | C04 | H042 | 88.0° | 60.0° |
| C06 | C05 | H051 | H052 | 118.8° | 120.0° |
| C05 | C06 | H061 | H062 | 118.8° | 120.0° |
| C05 | C06 | C07 | H071 | 70.8° | 60.1° |
| C05 | C06 | C07 | H072 | 48.5° | 60.0° |
| C05 | C04 | C03 | H041 | 120.3° | 120.0° |
| C05 | C04 | C03 | H042 | 120.3° | 120.0° |
| C05 | C04 | C03 | C02 | 167.7° | 180.0° |
| C05 | C04 | C03 | H032 | 47.1° | 60.0° |
| C05 | C04 | C03 | H031 | 71.7° | 60.0° |
| C05 | C04 | H041 | H042 | 119.1° | 120.0° |
| C04 | C05 | H051 | H052 | 118.9° | 120.0° |
| C04 | C05 | C06 | H061 | 62.2° | 60.0° |
| C04 | C05 | C06 | H062 | 57.0° | 60.0° |
| C04 | C03 | C02 | H032 | 120.6° | 120.0° |
| C04 | C03 | C02 | H031 | 120.6° | 120.0° |
| C04 | C03 | C02 | P12 | 138.5° | 180.0° |
| C04 | C03 | C02 | N01 | 17.4° | 60.0° |
| C04 | C03 | C02 | P16 | 103.0° | 60.0° |
| C04 | C03 | H032 | H031 | 118.2° | 120.1° |
| C03 | C04 | H041 | H042 | 119.1° | 120.0° |
| C03 | C04 | C05 | H051 | 87.9° | 60.0° |
| C03 | C04 | C05 | H052 | 31.4° | 60.0° |
| C03 | C02 | P12 | O13 | 44.4° | 175.0° |
| C03 | C02 | P12 | O15 | 75.9° | 65.0° |
| C03 | C02 | P12 | N01 | 121.4° | 120.0° |
| C03 | C02 | P12 | P16 | 118.7° | 119.9° |
| C03 | C02 | N01 | P16 | 119.9° | 120.0° |
| C03 | C02 | P12 | O14 | 163.9° | 55.0° |
| C03 | C02 | P16 | O19 | 40.7° | 180.0° |
| C03 | C02 | P16 | O18 | 79.2° | 60.0° |
| C03 | C02 | P16 | O17 | 161.0° | 60.0° |
| C03 | C02 | N01 | H011 | 180.0° | 60.0° |
| C03 | C02 | N01 | H012 | 60.0° | 64.0° |
| C02 | C03 | H032 | H031 | 118.3° | 119.9° |
| C02 | C03 | C04 | H041 | 72.0° | 60.0° |
| C02 | C03 | C04 | H042 | 47.4° | 60.0° |
| O13 | P12 | O15 | C02 | 120.1° | 120.0° |
| O13 | P12 | O15 | O14 | 119.8° | 120.0° |
| O13 | P12 | C02 | O14 | 119.5° | 120.0° |
| O13 | P12 | C02 | N01 | 165.8° | 65.0° |
| O13 | P12 | C02 | P16 | 74.3° | 55.1° |
| O13 | P12 | O14 | H2 | 0.0° | 60.0° |
| O13 | P12 | O15 | H3 | 0.0° | 180.0° |
| O15 | P12 | C02 | O14 | 120.2° | 120.0° |
| O15 | P12 | C02 | N01 | 45.5° | 55.0° |
| O15 | P12 | C02 | P16 | 165.4° | 175.0° |
| O15 | P12 | O14 | H2 | 120.2° | 60.0° |
| P12 | C02 | N01 | P16 | 119.3° | 120.0° |
| P12 | C02 | P16 | O19 | 159.8° | 60.0° |
| P12 | C02 | P16 | O18 | 39.9° | 59.9° |
| P12 | C02 | P16 | O17 | 79.9° | 180.0° |
| P12 | C02 | N01 | H011 | 59.1° | 60.0° |
| P12 | C02 | N01 | H012 | 60.9° | 176.0° |
| P12 | C02 | C03 | H032 | 100.9° | 60.0° |
| P12 | C02 | C03 | H031 | 17.9° | 60.0° |
| C02 | P12 | O14 | H2 | 119.7° | 180.0° |
| C02 | P12 | O15 | H3 | 120.1° | 60.1° |
| N01 | C02 | P12 | O14 | 74.7° | 175.0° |
| N01 | C02 | P16 | O19 | 80.1° | 60.0° |
| N01 | C02 | P16 | O18 | 160.0° | 180.0° |
| N01 | C02 | P16 | O17 | 40.2° | 60.0° |
| C02 | N01 | H011 | H012 | 120.0° | 124.0° |
| N01 | C02 | C03 | H032 | 138.0° | 60.0° |
| N01 | C02 | C03 | H031 | 103.1° | 180.0° |
| P16 | C02 | P12 | O14 | 45.3° | 65.0° |
| C02 | P16 | O19 | O18 | 119.6° | 120.0° |
| C02 | P16 | O19 | O17 | 120.0° | 120.0° |
| C02 | P16 | O18 | O17 | 119.6° | 120.0° |
| P16 | C02 | N01 | H011 | 60.1° | 180.0° |
| P16 | C02 | N01 | H012 | 179.9° | 56.0° |
| P16 | C02 | C03 | H032 | 17.6° | 180.0° |
| P16 | C02 | C03 | H031 | 136.4° | 60.0° |
| C02 | P16 | O17 | H4 | 120.2° | 180.0° |
| C02 | P16 | O18 | H5 | 120.0° | 60.0° |
| O14 | P12 | O15 | H3 | 119.8° | 59.9° |
| O19 | P16 | O18 | O17 | 120.5° | 120.0° |
| O19 | P16 | O17 | H4 | 0.0° | 60.0° |
| O19 | P16 | O18 | H5 | 0.0° | 180.0° |
| O18 | P16 | O17 | H4 | 120.3° | 60.0° |
| O17 | P16 | O18 | H5 | 120.5° | 60.0° |
| H032 | C03 | C04 | H041 | 167.4° | 180.0° |
| H032 | C03 | C04 | H042 | 73.2° | 60.0° |
| H031 | C03 | C04 | H041 | 48.6° | 60.0° |
| H031 | C03 | C04 | H042 | 168.0° | 180.0° |
| H041 | C04 | C05 | H051 | 151.8° | 180.0° |
| H041 | C04 | C05 | H052 | 89.0° | 60.0° |
| H042 | C04 | C05 | H051 | 32.4° | 60.0° |
| H042 | C04 | C05 | H052 | 151.7° | NaN° |
| H051 | C05 | C06 | H061 | 177.4° | 180.0° |
| H051 | C05 | C06 | H062 | 63.4° | 60.0° |
| H052 | C05 | C06 | H061 | 58.2° | 60.0° |
| H052 | C05 | C06 | H062 | 177.4° | 180.0° |
| H061 | C06 | C07 | H071 | 168.8° | 179.9° |
| H061 | C06 | C07 | H072 | 71.9° | 60.0° |
| H062 | C06 | C07 | H071 | 49.6° | 59.9° |
| H062 | C06 | C07 | H072 | 168.9° | 180.0° |
| H071 | C07 | C08 | H081 | 114.9° | 180.0° |
| H071 | C07 | C08 | H082 | 125.9° | 60.0° |
| H072 | C07 | C08 | H081 | 4.4° | 60.0° |
| H072 | C07 | C08 | H082 | 114.8° | 180.0° |
| H081 | C08 | C09 | H091 | 174.9° | 180.0° |
| H081 | C08 | C09 | H092 | 65.9° | 60.0° |
| H082 | C08 | C09 | H091 | 55.6° | 60.0° |
| H082 | C08 | C09 | H092 | 174.9° | 180.0° |
| H091 | C09 | C10 | H101 | 101.0° | 180.0° |
| H091 | C09 | C10 | H102 | 18.3° | 60.0° |
| H092 | C09 | C10 | H101 | 139.7° | 60.0° |
| H092 | C09 | C10 | H102 | 100.9° | 180.0° |
| H101 | C10 | C11 | H112 | 59.6° | 60.0° |
| H101 | C10 | C11 | H111 | 60.3° | 180.0° |
| H101 | C10 | C11 | H113 | 179.7° | 60.0° |
| H102 | C10 | C11 | H112 | 59.7° | 60.0° |
| H102 | C10 | C11 | H111 | 179.6° | 60.0° |
| H102 | C10 | C11 | H113 | 60.4° | 180.0° |
| H112 | C11 | H111 | H113 | 120.0° | 120.0° |
