104
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.47Å | 1.51Å | |
| N1 | H11 | sing | 1.01Å | 1.02Å | |
| N1 | H12 | sing | 1.01Å | 1.02Å | |
| C2 | C3 | sing | 1.53Å | 1.44Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | N4 | sing | 1.47Å | 1.49Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| N4 | C5 | sing | 1.47Å | 1.51Å | |
| N4 | HN4 | sing | 1.01Å | 1.02Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.12Å | |
| C6 | N7 | sing | 1.47Å | 1.53Å | |
| C6 | H61 | sing | 1.09Å | 1.12Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| N7 | C8 | sing | 1.47Å | 1.50Å | |
| N7 | HN7 | sing | 1.01Å | 1.02Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | H81 | sing | 1.09Å | 1.11Å | |
| C8 | H82 | sing | 1.09Å | 1.12Å | |
| C9 | N10 | sing | 1.47Å | 1.50Å | |
| C9 | H91 | sing | 1.09Å | 1.12Å | |
| C9 | H92 | sing | 1.09Å | 1.11Å | |
| N10 | H101 | sing | 1.01Å | 1.02Å | |
| N10 | H102 | sing | 1.01Å | 1.02Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | H11 | 122.5° | 106.6° |
| C2 | N1 | H12 | 107.6° | 106.8° |
| N1 | C2 | C3 | 122.5° | 109.5° |
| N1 | C2 | H21 | 107.6° | 109.5° |
| N1 | C2 | H22 | 107.6° | 109.4° |
| H11 | N1 | H12 | 107.5° | 106.7° |
| C3 | C2 | H21 | 107.6° | 109.5° |
| C3 | C2 | H22 | 107.6° | 109.4° |
| C2 | C3 | N4 | 134.4° | 109.5° |
| C2 | C3 | H31 | 103.6° | 109.5° |
| C2 | C3 | H32 | 103.6° | 109.5° |
| H21 | C2 | H22 | 102.2° | 109.5° |
| N4 | C3 | H31 | 103.6° | 109.5° |
| N4 | C3 | H32 | 103.6° | 109.5° |
| C3 | N4 | C5 | 115.2° | 106.8° |
| C3 | N4 | HN4 | 110.1° | 106.7° |
| H31 | C3 | H32 | 105.0° | 109.4° |
| C5 | N4 | HN4 | 110.1° | 106.7° |
| N4 | C5 | C6 | 118.1° | 109.5° |
| N4 | C5 | H51 | 109.1° | 109.5° |
| N4 | C5 | H52 | 109.1° | 109.4° |
| C6 | C5 | H51 | 109.1° | 109.5° |
| C6 | C5 | H52 | 109.1° | 109.5° |
| C5 | C6 | N7 | 109.0° | 109.5° |
| C5 | C6 | H61 | 112.3° | 109.6° |
| C5 | C6 | H62 | 112.4° | 109.4° |
| H51 | C5 | H52 | 101.0° | 109.4° |
| N7 | C6 | H61 | 112.4° | 109.5° |
| N7 | C6 | H62 | 112.4° | 109.3° |
| C6 | N7 | C8 | 158.2° | 106.8° |
| C6 | N7 | HN7 | 96.3° | 106.8° |
| H61 | C6 | H62 | 98.1° | 109.5° |
| C8 | N7 | HN7 | 96.4° | 106.7° |
| N7 | C8 | C9 | 128.0° | 109.5° |
| N7 | C8 | H81 | 105.7° | 109.5° |
| N7 | C8 | H82 | 105.7° | 109.4° |
| C9 | C8 | H81 | 105.7° | 109.5° |
| C9 | C8 | H82 | 105.7° | 109.4° |
| C8 | C9 | N10 | 113.0° | 109.5° |
| C8 | C9 | H91 | 110.9° | 109.5° |
| C8 | C9 | H92 | 110.9° | 109.5° |
| H81 | C8 | H82 | 103.6° | 109.5° |
| N10 | C9 | H91 | 110.9° | 109.5° |
| N10 | C9 | H92 | 110.9° | 109.5° |
| C9 | N10 | H101 | 113.0° | 106.8° |
| C9 | N10 | H102 | 110.9° | 106.7° |
| H91 | C9 | H92 | 99.4° | 109.4° |
| H101 | N10 | H102 | 110.9° | 106.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | H11 | H12 | 125.3° | 113.9° |
| N1 | C2 | C3 | H21 | 125.3° | 120.1° |
| N1 | C2 | C3 | H22 | 125.2° | 120.0° |
| N1 | C2 | H21 | H22 | 113.1° | 120.0° |
| N1 | C2 | C3 | N4 | 3.1° | 180.0° |
| N1 | C2 | C3 | H31 | 128.3° | 59.9° |
| N1 | C2 | C3 | H32 | 122.2° | 60.0° |
| H11 | N1 | C2 | C3 | 180.0° | 66.2° |
| H11 | N1 | C2 | H21 | 54.8° | 53.8° |
| H11 | N1 | C2 | H22 | 54.7° | 173.8° |
| H12 | N1 | C2 | C3 | 54.8° | 180.0° |
| H12 | N1 | C2 | H21 | 180.0° | 60.0° |
| H12 | N1 | C2 | H22 | 70.5° | 60.0° |
| C3 | C2 | H21 | H22 | 113.2° | 119.9° |
| C2 | C3 | N4 | H31 | 125.3° | 120.1° |
| C2 | C3 | N4 | H32 | 125.2° | 120.0° |
| C2 | C3 | H31 | H32 | 108.4° | 119.9° |
| C2 | C3 | N4 | C5 | 153.2° | 180.0° |
| C2 | C3 | N4 | HN4 | 27.9° | 66.2° |
| H21 | C2 | C3 | N4 | 122.2° | 59.9° |
| H21 | C2 | C3 | H31 | 3.1° | 180.0° |
| H21 | C2 | C3 | H32 | 112.5° | 60.1° |
| H22 | C2 | C3 | N4 | 128.3° | 60.0° |
| H22 | C2 | C3 | H31 | 106.4° | 60.0° |
| H22 | C2 | C3 | H32 | 3.1° | 179.9° |
| N4 | C3 | H31 | H32 | 108.4° | 120.0° |
| C3 | N4 | C5 | HN4 | 125.3° | 113.8° |
| C3 | N4 | C5 | C6 | 137.4° | 180.0° |
| C3 | N4 | C5 | H51 | 12.1° | 60.0° |
| C3 | N4 | C5 | H52 | 97.4° | 60.0° |
| H31 | C3 | N4 | C5 | 27.9° | 59.9° |
| H31 | C3 | N4 | HN4 | 97.4° | 173.8° |
| H32 | C3 | N4 | C5 | 81.5° | 60.0° |
| H32 | C3 | N4 | HN4 | 153.1° | 53.9° |
| N4 | C5 | C6 | H51 | 125.3° | 120.1° |
| N4 | C5 | C6 | H52 | 125.2° | 119.9° |
| N4 | C5 | H51 | H52 | 114.8° | 119.9° |
| N4 | C5 | C6 | N7 | 118.2° | 180.0° |
| N4 | C5 | C6 | H61 | 7.0° | 60.0° |
| N4 | C5 | C6 | H62 | 116.6° | 60.1° |
| HN4 | N4 | C5 | C6 | 12.1° | 66.2° |
| HN4 | N4 | C5 | H51 | 113.2° | 173.7° |
| HN4 | N4 | C5 | H52 | 137.3° | 53.8° |
| C6 | C5 | H51 | H52 | 114.8° | 120.0° |
| C5 | C6 | N7 | H61 | 125.2° | 120.1° |
| C5 | C6 | N7 | H62 | 125.3° | 119.9° |
| C5 | C6 | H61 | H62 | 118.3° | 120.0° |
| C5 | C6 | N7 | C8 | 59.0° | 180.0° |
| C5 | C6 | N7 | HN7 | 175.7° | 66.1° |
| H51 | C5 | C6 | N7 | 116.6° | 59.9° |
| H51 | C5 | C6 | H61 | 118.2° | 180.0° |
| H51 | C5 | C6 | H62 | 8.7° | 60.0° |
| H52 | C5 | C6 | N7 | 7.0° | 60.1° |
| H52 | C5 | C6 | H61 | 132.3° | 60.0° |
| H52 | C5 | C6 | H62 | 118.2° | 180.0° |
| N7 | C6 | H61 | H62 | 118.3° | 119.9° |
| C6 | N7 | C8 | HN7 | 125.3° | 113.9° |
| C6 | N7 | C8 | C9 | 132.5° | 180.0° |
| C6 | N7 | C8 | H81 | 7.3° | 59.9° |
| C6 | N7 | C8 | H82 | 102.2° | 60.1° |
| H61 | C6 | N7 | C8 | 175.8° | 59.9° |
| H61 | C6 | N7 | HN7 | 50.5° | 173.7° |
| H62 | C6 | N7 | C8 | 66.3° | 60.1° |
| H62 | C6 | N7 | HN7 | 59.0° | 53.8° |
| N7 | C8 | C9 | H81 | 125.3° | 120.1° |
| N7 | C8 | C9 | H82 | 125.2° | 119.9° |
| N7 | C8 | H81 | H82 | 111.0° | 119.9° |
| N7 | C8 | C9 | N10 | 172.0° | 180.0° |
| N7 | C8 | C9 | H91 | 62.8° | 59.9° |
| N7 | C8 | C9 | H92 | 46.7° | 60.0° |
| HN7 | N7 | C8 | C9 | 7.2° | 66.1° |
| HN7 | N7 | C8 | H81 | 118.0° | 173.8° |
| HN7 | N7 | C8 | H82 | 132.5° | 53.8° |
| C9 | C8 | H81 | H82 | 111.0° | 119.9° |
| C8 | C9 | N10 | H91 | 125.2° | 120.1° |
| C8 | C9 | N10 | H92 | 125.3° | 120.0° |
| C8 | C9 | H91 | H92 | 116.8° | 119.9° |
| C8 | C9 | N10 | H101 | 180.0° | 180.0° |
| C8 | C9 | N10 | H102 | 54.8° | 66.2° |
| H81 | C8 | C9 | N10 | 46.7° | 59.9° |
| H81 | C8 | C9 | H91 | 172.0° | 180.0° |
| H81 | C8 | C9 | H92 | 78.6° | 60.1° |
| H82 | C8 | C9 | N10 | 62.8° | 60.0° |
| H82 | C8 | C9 | H91 | 62.5° | 60.0° |
| H82 | C8 | C9 | H92 | 171.9° | 179.9° |
| N10 | C9 | H91 | H92 | 116.8° | 120.0° |
| C9 | N10 | H101 | H102 | 125.2° | 113.8° |
| H91 | C9 | N10 | H101 | 54.7° | 59.9° |
| H91 | C9 | N10 | H102 | 70.5° | 173.8° |
| H92 | C9 | N10 | H101 | 54.8° | 60.0° |
| H92 | C9 | N10 | H102 | 180.0° | 53.9° |
