7G0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O02 | C15 | sing | 1.43Å | 1.41Å | |
| C14 | C15 | sing | 1.57Å | 1.54Å | |
| C14 | C13 | sing | 1.55Å | 1.55Å | |
| C15 | C10 | sing | 1.52Å | 1.53Å | |
| C16 | C10 | sing | 1.53Å | 1.55Å | |
| C13 | C09 | sing | 1.53Å | 1.53Å | |
| C10 | C09 | sing | 1.55Å | 1.55Å | |
| C10 | C11 | sing | 1.52Å | 1.54Å | |
| C09 | C08 | sing | 1.52Å | 1.53Å | |
| C11 | C12 | sing | 1.54Å | 1.54Å | |
| C08 | C07 | sing | 1.54Å | 1.55Å | |
| C12 | C07 | sing | 1.52Å | 1.54Å | |
| C07 | C05 | sing | 1.51Å | 1.53Å | |
| C06 | C05 | doub | 1.38Å | 1.34Å | Aromatic |
| C06 | C01 | sing | 1.38Å | 1.34Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.35Å | Aromatic |
| C01 | C02 | doub | 1.39Å | 1.34Å | Aromatic |
| C04 | C03 | doub | 1.38Å | 1.35Å | Aromatic |
| C02 | C03 | sing | 1.39Å | 1.35Å | Aromatic |
| C02 | O01 | sing | 1.36Å | 1.36Å | |
| C01 | H1 | sing | 1.08Å | 1.08Å | |
| C03 | H2 | sing | 1.08Å | 1.08Å | |
| C04 | H3 | sing | 1.08Å | 1.08Å | |
| C06 | H4 | sing | 1.08Å | 1.08Å | |
| O01 | H5 | sing | 0.97Å | 0.95Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C09 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| O02 | H19 | sing | 0.97Å | 0.95Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O02 | C15 | C14 | 112.3° | 110.2° |
| O02 | C15 | C10 | 113.0° | 110.2° |
| O02 | C15 | H18 | 110.1° | 110.3° |
| C15 | O02 | H19 | 109.5° | 114.0° |
| C15 | C14 | C13 | 106.3° | 106.3° |
| C14 | C15 | C10 | 104.3° | 105.2° |
| C15 | C14 | H16 | 110.3° | 110.0° |
| C15 | C14 | H17 | 110.3° | 110.0° |
| C14 | C15 | H18 | 108.4° | 110.3° |
| C14 | C13 | C09 | 102.9° | 103.0° |
| C14 | C13 | H14 | 111.0° | 110.8° |
| C14 | C13 | H15 | 111.1° | 110.9° |
| C13 | C14 | H16 | 110.3° | 110.2° |
| C13 | C14 | H17 | 110.3° | 110.0° |
| C15 | C10 | C16 | 108.9° | 109.8° |
| C15 | C10 | C09 | 98.5° | 103.3° |
| C15 | C10 | C11 | 114.7° | 116.5° |
| C10 | C15 | H18 | 108.4° | 110.5° |
| C16 | C10 | C09 | 114.8° | 109.8° |
| C16 | C10 | C11 | 111.1° | 109.7° |
| C10 | C16 | H20 | 109.5° | 109.5° |
| C10 | C16 | H21 | 109.5° | 109.5° |
| C10 | C16 | H22 | 109.4° | 109.5° |
| C13 | C09 | C10 | 103.1° | 102.3° |
| C13 | C09 | C08 | 119.7° | 115.8° |
| C13 | C09 | H9 | 106.4° | 110.4° |
| C09 | C13 | H14 | 111.1° | 110.7° |
| C09 | C13 | H15 | 111.1° | 110.7° |
| C09 | C10 | C11 | 108.5° | 107.3° |
| C10 | C09 | C08 | 114.1° | 107.0° |
| C10 | C09 | H9 | 106.2° | 110.5° |
| C10 | C11 | C12 | 111.9° | 107.2° |
| C10 | C11 | H10 | 108.9° | 109.9° |
| C10 | C11 | H11 | 108.9° | 109.9° |
| C09 | C08 | C07 | 107.2° | 107.2° |
| C09 | C08 | H7 | 110.0° | 109.9° |
| C09 | C08 | H8 | 110.0° | 110.0° |
| C08 | C09 | H9 | 106.4° | 110.4° |
| C11 | C12 | C07 | 113.3° | 111.5° |
| C12 | C11 | H10 | 108.9° | 109.9° |
| C12 | C11 | H11 | 108.9° | 109.9° |
| C11 | C12 | H12 | 108.5° | 109.1° |
| C11 | C12 | H13 | 108.5° | 109.0° |
| C08 | C07 | C12 | 111.8° | 111.5° |
| C08 | C07 | C05 | 114.5° | 109.0° |
| C08 | C07 | H6 | 105.9° | 109.1° |
| C07 | C08 | H7 | 110.0° | 109.8° |
| C07 | C08 | H8 | 110.0° | 109.9° |
| C12 | C07 | C05 | 111.7° | 109.1° |
| C12 | C07 | H6 | 106.0° | 109.1° |
| C07 | C12 | H12 | 108.5° | 109.0° |
| C07 | C12 | H13 | 108.5° | 109.2° |
| C07 | C05 | C06 | 122.0° | 119.9° |
| C07 | C05 | C04 | 120.7° | 119.9° |
| C05 | C07 | H6 | 106.2° | 109.0° |
| C05 | C06 | C01 | 121.0° | 120.1° |
| C06 | C05 | C04 | 117.3° | 120.1° |
| C05 | C06 | H4 | 119.5° | 120.0° |
| C06 | C01 | C02 | 121.9° | 119.9° |
| C06 | C01 | H1 | 119.1° | 120.0° |
| C01 | C06 | H4 | 119.5° | 119.9° |
| C05 | C04 | C03 | 121.8° | 120.1° |
| C05 | C04 | H3 | 119.1° | 120.0° |
| C01 | C02 | C03 | 117.5° | 119.9° |
| C01 | C02 | O01 | 121.5° | 120.1° |
| C02 | C01 | H1 | 119.1° | 120.0° |
| C04 | C03 | C02 | 120.6° | 119.9° |
| C04 | C03 | H2 | 119.7° | 120.1° |
| C03 | C04 | H3 | 119.1° | 120.0° |
| C03 | C02 | O01 | 121.1° | 120.0° |
| C02 | C03 | H2 | 119.7° | 120.0° |
| C02 | O01 | H5 | 109.5° | 114.0° |
| H7 | C08 | H8 | 109.5° | 109.9° |
| H10 | C11 | H11 | 109.5° | 109.9° |
| H12 | C12 | H13 | 109.4° | 109.0° |
| H14 | C13 | H15 | 109.5° | 110.7° |
| H16 | C14 | H17 | 109.5° | 110.2° |
| H20 | C16 | H21 | 109.5° | 109.4° |
| H20 | C16 | H22 | 109.5° | 109.5° |
| H21 | C16 | H22 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O02 | C15 | C14 | C10 | 122.7° | 118.8° |
| O02 | C15 | C14 | H18 | 121.9° | 122.0° |
| O02 | C15 | C14 | C13 | 143.9° | 122.4° |
| O02 | C15 | C10 | H18 | 122.4° | 122.2° |
| O02 | C15 | C10 | C16 | 45.1° | 30.7° |
| O02 | C15 | C10 | C09 | 165.0° | 147.8° |
| O02 | C15 | C10 | C11 | 80.1° | 94.8° |
| O02 | C15 | C14 | H16 | 96.6° | 3.1° |
| O02 | C15 | C14 | H17 | 24.4° | 118.5° |
| C15 | C14 | C13 | H16 | 119.5° | 119.2° |
| C15 | C14 | C13 | H17 | 119.5° | 119.1° |
| C14 | C15 | C10 | H18 | 115.4° | 119.0° |
| C14 | C15 | C10 | C16 | 77.1° | 88.2° |
| C15 | C14 | C13 | C09 | 9.6° | 23.4° |
| C14 | C15 | C10 | C09 | 42.8° | 28.9° |
| C14 | C15 | C10 | C11 | 157.7° | 146.3° |
| C15 | C14 | C13 | H14 | 128.6° | 95.0° |
| C15 | C14 | C13 | H15 | 109.3° | 141.8° |
| C15 | C14 | H16 | H17 | 121.5° | 121.5° |
| C14 | C15 | O02 | H19 | 180.0° | 61.4° |
| C13 | C14 | C15 | C10 | 21.2° | 3.6° |
| C14 | C13 | C09 | H14 | 118.9° | 118.4° |
| C14 | C13 | C09 | H15 | 119.0° | 118.5° |
| C14 | C13 | C09 | C10 | 36.9° | 41.1° |
| C14 | C13 | C09 | C08 | 164.9° | 157.2° |
| C14 | C13 | C09 | H9 | 74.7° | 76.5° |
| C14 | C13 | H14 | H15 | 123.1° | 123.4° |
| C13 | C14 | H16 | H17 | 121.5° | 121.6° |
| C13 | C14 | C15 | H18 | 94.2° | 115.5° |
| C15 | C10 | C16 | C09 | 109.2° | 113.0° |
| C15 | C10 | C16 | C11 | 127.2° | 129.3° |
| C15 | C10 | C09 | C13 | 49.4° | 44.0° |
| C15 | C10 | C09 | C11 | 119.7° | 123.7° |
| C15 | C10 | C09 | C08 | 179.1° | 166.2° |
| C15 | C10 | C11 | C12 | 161.6° | 179.7° |
| C15 | C10 | C09 | H9 | 62.2° | 73.5° |
| C15 | C10 | C11 | H10 | 78.0° | 60.8° |
| C15 | C10 | C11 | H11 | 41.3° | 60.2° |
| C10 | C15 | C14 | H16 | 140.7° | 115.7° |
| C10 | C15 | C14 | H17 | 98.3° | 122.7° |
| C10 | C15 | O02 | H19 | 62.3° | 177.1° |
| C15 | C10 | C16 | H20 | 180.0° | 52.9° |
| C15 | C10 | C16 | H21 | 60.0° | 67.0° |
| C15 | C10 | C16 | H22 | 60.0° | 172.9° |
| C16 | C10 | C09 | C13 | 65.9° | 73.1° |
| C16 | C10 | C09 | C11 | 124.9° | 119.2° |
| C16 | C10 | C09 | C08 | 65.5° | 49.1° |
| C16 | C10 | C11 | C12 | 74.4° | 54.8° |
| C16 | C10 | C09 | H9 | 177.6° | 169.4° |
| C16 | C10 | C11 | H10 | 46.0° | 64.7° |
| C16 | C10 | C11 | H11 | 165.3° | 174.2° |
| C16 | C10 | C15 | H18 | 167.5° | 152.8° |
| C10 | C16 | H20 | H21 | 120.0° | 120.0° |
| C10 | C16 | H20 | H22 | 120.0° | 120.0° |
| C10 | C16 | H21 | H22 | 120.0° | 120.0° |
| C13 | C09 | C10 | C08 | 131.4° | 122.2° |
| C13 | C09 | C10 | H9 | 111.7° | 117.6° |
| C13 | C09 | C10 | C11 | 169.1° | 167.8° |
| C13 | C09 | C08 | H9 | 120.4° | 126.4° |
| C13 | C09 | C08 | C07 | 176.9° | 177.9° |
| C13 | C09 | C08 | H7 | 57.3° | 58.6° |
| C13 | C09 | C08 | H8 | 63.5° | 62.6° |
| C09 | C13 | H14 | H15 | 123.0° | 123.1° |
| C09 | C13 | C14 | H16 | 109.9° | 142.6° |
| C09 | C13 | C14 | H17 | 129.1° | 95.7° |
| C10 | C09 | C08 | H9 | 116.8° | 120.3° |
| C09 | C10 | C11 | C12 | 52.7° | 64.5° |
| C10 | C09 | C08 | C07 | 60.3° | 64.6° |
| C10 | C09 | C08 | H7 | 180.0° | 54.8° |
| C10 | C09 | C08 | H8 | 59.3° | 175.9° |
| C09 | C10 | C11 | H10 | 173.1° | 176.0° |
| C09 | C10 | C11 | H11 | 67.6° | 55.0° |
| C10 | C09 | C13 | H14 | 155.8° | 77.3° |
| C10 | C09 | C13 | H15 | 82.1° | 159.7° |
| C09 | C10 | C15 | H18 | 72.6° | 90.1° |
| C09 | C10 | C16 | H20 | 70.8° | 60.0° |
| C09 | C10 | C16 | H21 | 49.2° | 180.0° |
| C09 | C10 | C16 | H22 | 169.2° | 59.9° |
| C11 | C10 | C09 | C08 | 59.5° | 70.0° |
| C10 | C11 | C12 | H10 | 120.4° | 119.5° |
| C10 | C11 | C12 | H11 | 120.3° | 119.4° |
| C10 | C11 | C12 | C07 | 52.0° | 57.6° |
| C11 | C10 | C09 | H9 | 57.5° | 50.2° |
| C10 | C11 | H10 | H11 | 118.9° | 121.1° |
| C10 | C11 | C12 | H12 | 68.6° | 178.0° |
| C10 | C11 | C12 | H13 | 172.6° | 63.0° |
| C11 | C10 | C15 | H18 | 42.3° | 27.4° |
| C11 | C10 | C16 | H20 | 52.8° | 177.8° |
| C11 | C10 | C16 | H21 | 172.8° | 62.3° |
| C11 | C10 | C16 | H22 | 67.2° | 57.8° |
| C09 | C08 | C07 | H7 | 119.7° | 119.4° |
| C09 | C08 | C07 | H8 | 119.7° | 119.5° |
| C09 | C08 | C07 | C12 | 55.3° | 57.8° |
| C09 | C08 | C07 | C05 | 176.3° | 178.3° |
| C09 | C08 | C07 | H6 | 59.7° | 62.7° |
| C09 | C08 | H7 | H8 | 121.1° | 121.2° |
| C08 | C09 | C13 | H14 | 76.2° | 38.8° |
| C08 | C09 | C13 | H15 | 45.9° | 84.3° |
| C11 | C12 | C07 | C08 | 53.6° | 54.9° |
| C11 | C12 | C07 | H12 | 120.6° | 120.5° |
| C11 | C12 | C07 | H13 | 120.6° | 120.5° |
| C11 | C12 | C07 | C05 | 176.6° | 175.4° |
| C11 | C12 | C07 | H6 | 61.4° | 65.7° |
| C12 | C11 | H10 | H11 | 118.9° | 121.1° |
| C11 | C12 | H12 | H13 | 118.3° | 119.0° |
| C08 | C07 | C12 | C05 | 129.8° | 120.5° |
| C08 | C07 | C12 | H6 | 115.0° | 120.5° |
| C08 | C07 | C05 | H6 | 116.5° | 119.0° |
| C08 | C07 | C05 | C06 | 0.3° | 61.3° |
| C08 | C07 | C05 | C04 | 179.9° | 119.0° |
| C07 | C08 | H7 | H8 | 121.0° | 121.1° |
| C07 | C08 | C09 | H9 | 56.5° | 55.7° |
| C08 | C07 | C12 | H12 | 67.0° | 175.3° |
| C08 | C07 | C12 | H13 | 174.1° | 65.6° |
| C12 | C07 | C05 | H6 | 115.1° | 119.0° |
| C12 | C07 | C05 | C06 | 128.7° | 60.6° |
| C12 | C07 | C05 | C04 | 51.5° | 119.0° |
| C12 | C07 | C08 | H7 | 175.0° | 61.6° |
| C12 | C07 | C08 | H8 | 64.3° | 177.4° |
| C07 | C12 | C11 | H10 | 172.4° | 177.0° |
| C07 | C12 | C11 | H11 | 68.3° | 61.9° |
| C07 | C12 | H12 | H13 | 118.2° | 119.1° |
| C07 | C05 | C06 | C04 | 179.7° | 179.6° |
| C07 | C05 | C06 | C01 | 180.0° | 179.7° |
| C07 | C05 | C04 | C03 | 179.7° | 180.0° |
| C07 | C05 | C04 | H3 | 0.3° | 0.0° |
| C07 | C05 | C06 | H4 | 0.0° | 0.4° |
| C05 | C07 | C08 | H7 | 56.7° | 58.9° |
| C05 | C07 | C08 | H8 | 64.0° | 62.1° |
| C05 | C07 | C12 | H12 | 62.8° | 64.2° |
| C05 | C07 | C12 | H13 | 56.1° | 54.8° |
| C05 | C06 | C01 | H4 | 180.0° | 179.3° |
| C05 | C06 | C01 | C02 | 0.1° | 0.7° |
| C06 | C05 | C04 | C03 | 0.0° | 0.4° |
| C05 | C06 | C01 | H1 | 179.9° | 179.7° |
| C06 | C05 | C04 | H3 | 179.9° | 179.7° |
| C06 | C05 | C07 | H6 | 116.2° | 179.7° |
| C01 | C06 | C05 | C04 | 0.2° | 0.7° |
| C06 | C01 | C02 | H1 | 180.0° | 179.6° |
| C06 | C01 | C02 | C03 | 0.2° | 0.4° |
| C06 | C01 | C02 | O01 | 179.9° | 179.7° |
| C05 | C04 | C03 | H3 | 180.0° | 179.9° |
| C05 | C04 | C03 | C02 | 0.4° | 0.1° |
| C05 | C04 | C03 | H2 | 179.6° | 180.0° |
| C04 | C05 | C06 | H4 | 179.8° | 180.0° |
| C04 | C05 | C07 | H6 | 63.5° | 0.0° |
| C01 | C02 | C03 | C04 | 0.5° | 0.0° |
| C01 | C02 | C03 | O01 | 179.7° | 179.9° |
| C01 | C02 | C03 | H2 | 179.5° | 180.0° |
| C02 | C01 | C06 | H4 | 179.9° | 179.9° |
| C01 | C02 | O01 | H5 | 180.0° | 90.0° |
| C04 | C03 | C02 | H2 | 180.0° | 180.0° |
| C04 | C03 | C02 | O01 | 179.8° | 180.0° |
| C03 | C02 | C01 | H1 | 179.8° | 180.0° |
| C02 | C03 | C04 | H3 | 179.5° | 180.0° |
| C03 | C02 | O01 | H5 | 0.3° | 90.0° |
| O01 | C02 | C01 | H1 | 0.1° | 0.1° |
| O01 | C02 | C03 | H2 | 0.2° | 0.1° |
| H1 | C01 | C06 | H4 | 0.1° | 0.4° |
| H2 | C03 | C04 | H3 | 0.5° | 0.0° |
| H6 | C07 | C08 | H7 | 60.0° | 177.9° |
| H6 | C07 | C08 | H8 | 179.4° | 56.8° |
| H6 | C07 | C12 | H12 | 178.0° | 54.8° |
| H6 | C07 | C12 | H13 | 59.1° | 173.8° |
| H7 | C08 | C09 | H9 | 63.1° | 175.1° |
| H8 | C08 | C09 | H9 | 176.2° | 63.8° |
| H9 | C09 | C13 | H14 | 44.2° | 165.1° |
| H9 | C09 | C13 | H15 | 166.3° | 42.1° |
| H10 | C11 | C12 | H12 | 51.8° | 62.5° |
| H10 | C11 | C12 | H13 | 67.1° | 56.4° |
| H11 | C11 | C12 | H12 | 171.1° | 58.6° |
| H11 | C11 | C12 | H13 | 52.2° | 177.5° |
| H14 | C13 | C14 | H16 | 9.1° | 24.2° |
| H14 | C13 | C14 | H17 | 111.9° | 145.9° |
| H15 | C13 | C14 | H16 | 131.2° | 99.0° |
| H15 | C13 | C14 | H17 | 10.2° | 22.7° |
| H16 | C14 | C15 | H18 | 25.3° | 125.1° |
| H17 | C14 | C15 | H18 | 146.3° | 3.6° |
| H18 | C15 | O02 | H19 | 59.1° | 60.6° |
| H20 | C16 | H21 | H22 | 120.0° | 120.0° |
