GOY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C | C4 | sing | 1.53Å | 1.53Å | |
| C2 | N | sing | 1.47Å | 1.49Å | |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| N | C3 | sing | 1.47Å | 1.50Å | |
| N | C5 | sing | 1.35Å | 1.47Å | |
| O | C5 | doub | 1.22Å | 1.26Å | |
| C5 | N1 | sing | 1.35Å | 1.47Å | |
| C10 | N1 | sing | 1.47Å | 1.50Å | |
| C10 | C9 | sing | 1.53Å | 1.51Å | |
| N1 | C6 | sing | 1.47Å | 1.48Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | C7 | sing | 1.53Å | 1.56Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C2 | H16 | sing | 1.09Å | 1.10Å | |
| C3 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 112.3° | 109.3° |
| C1 | C | C4 | 113.0° | 109.6° |
| C1 | C | H11 | 108.6° | 109.5° |
| C1 | C | H12 | 108.6° | 109.5° |
| C | C1 | H13 | 108.7° | 109.5° |
| C | C1 | H14 | 108.7° | 109.5° |
| C1 | C2 | N | 107.5° | 108.8° |
| C2 | C1 | H13 | 108.8° | 109.5° |
| C2 | C1 | H14 | 108.7° | 109.5° |
| C1 | C2 | H15 | 109.9° | 109.6° |
| C1 | C2 | H16 | 110.0° | 109.5° |
| C | C4 | C3 | 114.1° | 109.3° |
| C | C4 | H1 | 108.3° | 109.5° |
| C | C4 | H2 | 108.3° | 109.5° |
| C4 | C | H11 | 108.6° | 109.4° |
| C4 | C | H12 | 108.6° | 109.4° |
| C2 | N | C3 | 114.0° | 118.7° |
| C2 | N | C5 | 119.3° | 120.6° |
| N | C2 | H15 | 110.0° | 109.6° |
| N | C2 | H16 | 110.0° | 109.6° |
| C4 | C3 | N | 113.4° | 108.8° |
| C3 | C4 | H1 | 108.3° | 109.4° |
| C3 | C4 | H2 | 108.3° | 109.5° |
| C4 | C3 | H17 | 108.5° | 109.6° |
| C4 | C3 | H18 | 108.5° | 109.6° |
| C3 | N | C5 | 121.6° | 120.7° |
| N | C3 | H17 | 108.5° | 109.6° |
| N | C3 | H18 | 108.5° | 109.6° |
| N | C5 | O | 121.1° | 120.0° |
| N | C5 | N1 | 116.7° | 120.0° |
| O | C5 | N1 | 122.1° | 120.0° |
| C5 | N1 | C10 | 121.0° | 120.6° |
| C5 | N1 | C6 | 119.3° | 120.7° |
| N1 | C10 | C9 | 107.4° | 109.0° |
| C10 | N1 | C6 | 107.5° | 118.7° |
| N1 | C10 | H9 | 110.0° | 109.6° |
| N1 | C10 | H10 | 110.0° | 109.6° |
| C10 | C9 | C8 | 107.0° | 109.4° |
| C9 | C10 | H9 | 110.0° | 109.7° |
| C9 | C10 | H10 | 110.0° | 109.3° |
| C10 | C9 | H19 | 110.1° | 109.5° |
| C10 | C9 | H20 | 110.1° | 109.6° |
| N1 | C6 | C7 | 110.3° | 108.8° |
| N1 | C6 | H3 | 109.3° | 109.6° |
| N1 | C6 | H4 | 109.3° | 109.5° |
| C9 | C8 | C7 | 112.7° | 109.5° |
| C9 | C8 | H7 | 108.7° | 109.5° |
| C9 | C8 | H8 | 108.6° | 109.5° |
| C8 | C9 | H19 | 110.1° | 109.6° |
| C8 | C9 | H20 | 110.1° | 109.3° |
| C6 | C7 | C8 | 114.3° | 109.3° |
| C7 | C6 | H3 | 109.2° | 109.6° |
| C7 | C6 | H4 | 109.3° | 109.6° |
| C6 | C7 | H5 | 108.3° | 109.5° |
| C6 | C7 | H6 | 108.3° | 109.5° |
| C8 | C7 | H5 | 108.2° | 109.5° |
| C8 | C7 | H6 | 108.2° | 109.5° |
| C7 | C8 | H7 | 108.6° | 109.4° |
| C7 | C8 | H8 | 108.6° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H3 | C6 | H4 | 109.5° | 109.6° |
| H5 | C7 | H6 | 109.5° | 109.5° |
| H7 | C8 | H8 | 109.5° | 109.4° |
| H9 | C10 | H10 | 109.5° | 109.7° |
| H11 | C | H12 | 109.5° | 109.5° |
| H13 | C1 | H14 | 109.5° | 109.5° |
| H15 | C2 | H16 | 109.4° | 109.7° |
| H17 | C3 | H18 | 109.5° | 109.7° |
| H19 | C9 | H20 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | H13 | 120.4° | 120.0° |
| C | C1 | C2 | H14 | 120.4° | 120.0° |
| C1 | C | C4 | H11 | 120.5° | 120.0° |
| C1 | C | C4 | H12 | 120.5° | 120.0° |
| C | C1 | C2 | N | 60.2° | 54.7° |
| C1 | C | C4 | C3 | 40.9° | 61.4° |
| C1 | C | C4 | H1 | 79.7° | 178.7° |
| C1 | C | C4 | H2 | 161.6° | 58.6° |
| C1 | C | H11 | H12 | 118.4° | 120.0° |
| C | C1 | H13 | H14 | 118.7° | 120.1° |
| C | C1 | C2 | H15 | 179.9° | 65.2° |
| C | C1 | C2 | H16 | 59.5° | 174.4° |
| C2 | C1 | C | C4 | 11.7° | 61.4° |
| C1 | C2 | N | H15 | 119.7° | 119.9° |
| C1 | C2 | N | H16 | 119.7° | 119.7° |
| C1 | C2 | N | C3 | 57.2° | 53.6° |
| C1 | C2 | N | C5 | 147.6° | 126.3° |
| C2 | C1 | C | H11 | 108.9° | 178.6° |
| C2 | C1 | C | H12 | 132.2° | 58.6° |
| C2 | C1 | H13 | H14 | 118.7° | 120.0° |
| C1 | C2 | H15 | H16 | 120.9° | 120.3° |
| C | C4 | C3 | H1 | 120.7° | 119.9° |
| C | C4 | C3 | H2 | 120.7° | 120.0° |
| C | C4 | C3 | N | 44.8° | 54.6° |
| C | C4 | H1 | H2 | 117.9° | 120.2° |
| C4 | C | H11 | H12 | 118.4° | 119.9° |
| C4 | C | C1 | H13 | 108.8° | 58.6° |
| C4 | C | C1 | H14 | 132.1° | 178.7° |
| C | C4 | C3 | H17 | 165.4° | 65.2° |
| C | C4 | C3 | H18 | 75.8° | 174.4° |
| C2 | N | C3 | C4 | 5.6° | 53.6° |
| C2 | N | C3 | C5 | 154.5° | 180.0° |
| C2 | N | C5 | O | 12.0° | 165.2° |
| C2 | N | C5 | N1 | 168.8° | 14.7° |
| N | C2 | C1 | H13 | 60.2° | 65.3° |
| N | C2 | C1 | H14 | 179.4° | 174.7° |
| N | C2 | H15 | H16 | 120.9° | 120.3° |
| C2 | N | C3 | H17 | 115.0° | 66.2° |
| C2 | N | C3 | H18 | 126.1° | 173.4° |
| C4 | C3 | N | H17 | 120.6° | 119.8° |
| C4 | C3 | N | H18 | 120.6° | 119.8° |
| C4 | C3 | N | C5 | 160.1° | 126.3° |
| C3 | C4 | H1 | H2 | 117.9° | 120.0° |
| C3 | C4 | C | H11 | 161.5° | 178.6° |
| C3 | C4 | C | H12 | 79.6° | 58.7° |
| C4 | C3 | H17 | H18 | 118.2° | 120.3° |
| C3 | N | C5 | O | 165.2° | 14.7° |
| C3 | N | C5 | N1 | 15.6° | 165.3° |
| N | C3 | C4 | H1 | 75.9° | 174.6° |
| N | C3 | C4 | H2 | 165.5° | 65.3° |
| C3 | N | C2 | H15 | 176.9° | 66.3° |
| C3 | N | C2 | H16 | 62.5° | 173.3° |
| N | C3 | H17 | H18 | 118.2° | 120.3° |
| N | C5 | O | N1 | 179.1° | 180.0° |
| N | C5 | N1 | C10 | 57.3° | 70.2° |
| N | C5 | N1 | C6 | 165.0° | 110.1° |
| C5 | N | C2 | H15 | 28.0° | 113.8° |
| C5 | N | C2 | H16 | 92.7° | 6.6° |
| C5 | N | C3 | H17 | 39.5° | 113.8° |
| C5 | N | C3 | H18 | 79.3° | 6.6° |
| O | C5 | N1 | C10 | 121.9° | 109.8° |
| O | C5 | N1 | C6 | 15.8° | 69.9° |
| C5 | N1 | C10 | C6 | 142.0° | 179.7° |
| C5 | N1 | C10 | C9 | 144.2° | 126.4° |
| C5 | N1 | C6 | C7 | 157.1° | 126.3° |
| C5 | N1 | C6 | H3 | 82.8° | 113.8° |
| C5 | N1 | C6 | H4 | 37.0° | 6.5° |
| C5 | N1 | C10 | H9 | 24.6° | 6.3° |
| C5 | N1 | C10 | H10 | 96.1° | 114.1° |
| N1 | C10 | C9 | H9 | 119.7° | 120.0° |
| N1 | C10 | C9 | H10 | 119.7° | 119.7° |
| N1 | C10 | C9 | C8 | 68.1° | 54.5° |
| C10 | N1 | C6 | C7 | 60.1° | 53.4° |
| C10 | N1 | C6 | H3 | 60.0° | 66.5° |
| C10 | N1 | C6 | H4 | 179.7° | 173.2° |
| N1 | C10 | H9 | H10 | 121.0° | 120.3° |
| N1 | C10 | C9 | H19 | 51.5° | 174.6° |
| N1 | C10 | C9 | H20 | 172.3° | 65.3° |
| C9 | C10 | N1 | C6 | 73.8° | 53.3° |
| C10 | C9 | C8 | H19 | 119.6° | 120.1° |
| C10 | C9 | C8 | H20 | 119.6° | 119.9° |
| C10 | C9 | C8 | C7 | 52.2° | 61.3° |
| C10 | C9 | C8 | H7 | 172.7° | 58.7° |
| C10 | C9 | C8 | H8 | 68.2° | 178.7° |
| C9 | C10 | H9 | H10 | 120.9° | 120.0° |
| C10 | C9 | H19 | H20 | 121.1° | 120.2° |
| N1 | C6 | C7 | H3 | 120.1° | 119.9° |
| N1 | C6 | C7 | H4 | 120.1° | 119.8° |
| N1 | C6 | C7 | C8 | 45.6° | 54.7° |
| N1 | C6 | H3 | H4 | 119.6° | 120.3° |
| N1 | C6 | C7 | H5 | 166.2° | 174.6° |
| N1 | C6 | C7 | H6 | 75.1° | 65.3° |
| C6 | N1 | C10 | H9 | 166.6° | 173.4° |
| C6 | N1 | C10 | H10 | 45.9° | 66.2° |
| C9 | C8 | C7 | C6 | 42.0° | 61.4° |
| C9 | C8 | C7 | H7 | 120.5° | 120.0° |
| C9 | C8 | C7 | H8 | 120.5° | 120.0° |
| C9 | C8 | C7 | H5 | 162.7° | 178.7° |
| C9 | C8 | C7 | H6 | 78.7° | 58.7° |
| C9 | C8 | H7 | H8 | 118.5° | 120.0° |
| C8 | C9 | C10 | H9 | 172.2° | 174.4° |
| C8 | C9 | C10 | H10 | 51.6° | 65.3° |
| C8 | C9 | H19 | H20 | 121.1° | 119.8° |
| C6 | C7 | C8 | H5 | 120.7° | 119.9° |
| C6 | C7 | C8 | H6 | 120.7° | 120.0° |
| C7 | C6 | H3 | H4 | 119.6° | 120.3° |
| C6 | C7 | H5 | H6 | 117.8° | 120.1° |
| C6 | C7 | C8 | H7 | 162.5° | 58.6° |
| C6 | C7 | C8 | H8 | 78.4° | 178.6° |
| C8 | C7 | C6 | H3 | 74.6° | 65.2° |
| C8 | C7 | C6 | H4 | 165.7° | 174.4° |
| C8 | C7 | H5 | H6 | 117.8° | 120.1° |
| C7 | C8 | H7 | H8 | 118.5° | 120.0° |
| C7 | C8 | C9 | H19 | 67.4° | 178.7° |
| C7 | C8 | C9 | H20 | 171.9° | 58.7° |
| H1 | C4 | C | H11 | 40.8° | 58.7° |
| H1 | C4 | C | H12 | 159.7° | 61.2° |
| H1 | C4 | C3 | H17 | 44.7° | 54.8° |
| H1 | C4 | C3 | H18 | 163.5° | 65.6° |
| H2 | C4 | C | H11 | 77.8° | 61.5° |
| H2 | C4 | C | H12 | 41.1° | 178.6° |
| H2 | C4 | C3 | H17 | 73.9° | 174.8° |
| H2 | C4 | C3 | H18 | 44.9° | 54.4° |
| H3 | C6 | C7 | H5 | 46.1° | 54.7° |
| H3 | C6 | C7 | H6 | 164.7° | 174.8° |
| H4 | C6 | C7 | H5 | 73.6° | 65.6° |
| H4 | C6 | C7 | H6 | 45.0° | 54.4° |
| H5 | C7 | C8 | H7 | 76.8° | 61.3° |
| H5 | C7 | C8 | H8 | 42.3° | 58.6° |
| H6 | C7 | C8 | H7 | 41.8° | 178.6° |
| H6 | C7 | C8 | H8 | 160.8° | 61.4° |
| H7 | C8 | C9 | H19 | 53.1° | 61.3° |
| H7 | C8 | C9 | H20 | 67.7° | 178.7° |
| H8 | C8 | C9 | H19 | 172.2° | 58.6° |
| H8 | C8 | C9 | H20 | 51.4° | 61.4° |
| H9 | C10 | C9 | H19 | 68.1° | 65.5° |
| H9 | C10 | C9 | H20 | 52.6° | 54.7° |
| H10 | C10 | C9 | H19 | 171.3° | 54.8° |
| H10 | C10 | C9 | H20 | 68.0° | 175.0° |
| H11 | C | C1 | H13 | 130.7° | 61.4° |
| H11 | C | C1 | H14 | 11.5° | 58.7° |
| H12 | C | C1 | H13 | 11.7° | 178.6° |
| H12 | C | C1 | H14 | 107.4° | 61.3° |
| H13 | C1 | C2 | H15 | 59.5° | 174.8° |
| H13 | C1 | C2 | H16 | 179.9° | 54.4° |
| H14 | C1 | C2 | H15 | 59.7° | 54.8° |
| H14 | C1 | C2 | H16 | 60.9° | 65.6° |
