RHY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C07 | C06 | sing | 1.55Å | 1.34Å | |
| C07 | C08 | sing | 1.55Å | 1.40Å | |
| C05 | C06 | sing | 1.54Å | 1.64Å | |
| C05 | N04 | sing | 1.47Å | 1.50Å | |
| C06 | C10 | sing | 1.55Å | 1.43Å | |
| N15 | C14 | doub | 1.31Å | 1.38Å | Aromatic |
| N15 | C16 | sing | 1.33Å | 1.34Å | Aromatic |
| C08 | C16 | sing | 1.52Å | 1.45Å | |
| C08 | O09 | sing | 1.46Å | 1.65Å | |
| C14 | N13 | sing | 1.36Å | 1.38Å | Aromatic |
| C16 | C12 | doub | 1.36Å | 1.47Å | Aromatic |
| O03 | C02 | doub | 1.21Å | 1.19Å | |
| N13 | C12 | sing | 1.35Å | 1.34Å | Aromatic |
| N04 | C02 | sing | 1.35Å | 1.43Å | |
| N04 | C17 | sing | 1.47Å | 1.51Å | |
| C12 | C11 | sing | 1.51Å | 1.55Å | |
| C02 | C01 | sing | 1.51Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C10 | O09 | sing | 1.43Å | 1.59Å | |
| C10 | C17 | sing | 1.53Å | 1.62Å | |
| C17 | H1 | sing | 1.09Å | 1.10Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C01 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C05 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.09Å | 1.10Å | |
| C06 | H8 | sing | 1.09Å | 1.10Å | |
| C07 | H9 | sing | 1.09Å | 1.10Å | |
| C07 | H10 | sing | 1.09Å | 1.10Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| N13 | H15 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C06 | C07 | C08 | 110.3° | 103.7° |
| C07 | C06 | C05 | 110.0° | 108.9° |
| C07 | C06 | C10 | 112.2° | 103.8° |
| C07 | C06 | H8 | 111.3° | 113.5° |
| C06 | C07 | H9 | 109.3° | 110.6° |
| C06 | C07 | H10 | 109.3° | 110.6° |
| C07 | C08 | C16 | 111.6° | 105.8° |
| C07 | C08 | O09 | 101.1° | 103.2° |
| C08 | C07 | H9 | 109.3° | 110.6° |
| C08 | C07 | H10 | 109.3° | 110.5° |
| C07 | C08 | H11 | 113.6° | 113.7° |
| C06 | C05 | N04 | 104.8° | 108.1° |
| C05 | C06 | C10 | 106.1° | 103.9° |
| C06 | C05 | H6 | 110.6° | 109.7° |
| C06 | C05 | H7 | 110.6° | 109.7° |
| C05 | C06 | H8 | 107.3° | 112.9° |
| C05 | N04 | C02 | 125.2° | 125.3° |
| C05 | N04 | C17 | 110.1° | 109.4° |
| N04 | C05 | H6 | 110.6° | 109.8° |
| N04 | C05 | H7 | 110.6° | 109.8° |
| C06 | C10 | C11 | 115.4° | 111.1° |
| C06 | C10 | O09 | 101.4° | 105.5° |
| C06 | C10 | C17 | 107.2° | 104.7° |
| C10 | C06 | H8 | 109.8° | 113.1° |
| C14 | N15 | C16 | 108.4° | 109.0° |
| N15 | C14 | N13 | 110.5° | 108.8° |
| N15 | C14 | H14 | 124.7° | 125.6° |
| N15 | C16 | C08 | 134.2° | 130.2° |
| N15 | C16 | C12 | 105.7° | 108.2° |
| C16 | C08 | O09 | 106.8° | 105.1° |
| C08 | C16 | C12 | 120.1° | 121.6° |
| C16 | C08 | H11 | 112.9° | 113.6° |
| C08 | O09 | C10 | 94.0° | 104.6° |
| O09 | C08 | H11 | 110.0° | 114.5° |
| C14 | N13 | C12 | 106.3° | 106.9° |
| N13 | C14 | H14 | 124.7° | 125.6° |
| C14 | N13 | H15 | 126.9° | 126.6° |
| C16 | C12 | N13 | 109.1° | 107.1° |
| C16 | C12 | C11 | 120.0° | 122.2° |
| O03 | C02 | N04 | 118.1° | 120.0° |
| O03 | C02 | C01 | 123.0° | 120.0° |
| N13 | C12 | C11 | 131.0° | 130.7° |
| C12 | N13 | H15 | 126.8° | 126.5° |
| C02 | N04 | C17 | 124.7° | 125.3° |
| N04 | C02 | C01 | 118.9° | 120.0° |
| N04 | C17 | C10 | 105.2° | 106.6° |
| N04 | C17 | H1 | 110.5° | 110.1° |
| N04 | C17 | H2 | 110.6° | 110.1° |
| C12 | C11 | C10 | 110.3° | 107.3° |
| C12 | C11 | H12 | 109.3° | 109.9° |
| C12 | C11 | H13 | 109.3° | 109.9° |
| C02 | C01 | H3 | 109.5° | 109.4° |
| C02 | C01 | H4 | 109.5° | 109.5° |
| C02 | C01 | H5 | 109.5° | 109.5° |
| C11 | C10 | O09 | 106.9° | 110.6° |
| C11 | C10 | C17 | 111.3° | 112.5° |
| C10 | C11 | H12 | 109.2° | 109.9° |
| C10 | C11 | H13 | 109.3° | 109.9° |
| O09 | C10 | C17 | 114.5° | 112.1° |
| C10 | C17 | H1 | 110.5° | 110.0° |
| C10 | C17 | H2 | 110.5° | 110.0° |
| H1 | C17 | H2 | 109.5° | 110.0° |
| H3 | C01 | H4 | 109.5° | 109.4° |
| H3 | C01 | H5 | 109.5° | 109.5° |
| H4 | C01 | H5 | 109.4° | 109.5° |
| H6 | C05 | H7 | 109.5° | 109.7° |
| H9 | C07 | H10 | 109.4° | 110.6° |
| H12 | C11 | H13 | 109.5° | 109.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C06 | C07 | C08 | H9 | 120.1° | 118.6° |
| C06 | C07 | C08 | H10 | 120.2° | 118.6° |
| C07 | C06 | C05 | C10 | 121.6° | 110.1° |
| C07 | C06 | C05 | H8 | 121.1° | 127.0° |
| C07 | C06 | C05 | N04 | 145.4° | 125.7° |
| C07 | C06 | C10 | H8 | 124.3° | 123.4° |
| C06 | C07 | C08 | C16 | 82.1° | 80.5° |
| C06 | C07 | C08 | O09 | 31.2° | 29.7° |
| C07 | C06 | C10 | C11 | 89.3° | 99.1° |
| C07 | C06 | C10 | O09 | 25.8° | 20.8° |
| C07 | C06 | C10 | C17 | 146.2° | 139.2° |
| C07 | C06 | C05 | H6 | 95.3° | 114.6° |
| C07 | C06 | C05 | H7 | 26.2° | 6.0° |
| C06 | C07 | H9 | H10 | 119.6° | 122.9° |
| C06 | C07 | C08 | H11 | 148.9° | 154.3° |
| C08 | C07 | C06 | C05 | 122.1° | 115.9° |
| C08 | C07 | C06 | C10 | 4.3° | 5.6° |
| C07 | C08 | C16 | N15 | 106.9° | 101.2° |
| C07 | C08 | C16 | O09 | 109.6° | 108.7° |
| C07 | C08 | C16 | H11 | 129.4° | 125.3° |
| C07 | C08 | O09 | H11 | 120.4° | 124.0° |
| C07 | C08 | C16 | C12 | 72.1° | 78.8° |
| C07 | C08 | O09 | C10 | 42.2° | 44.3° |
| C08 | C07 | C06 | H8 | 119.2° | 117.5° |
| C08 | C07 | H9 | H10 | 119.6° | 122.8° |
| C06 | C05 | N04 | H6 | 119.3° | 119.6° |
| C06 | C05 | N04 | H7 | 119.3° | 119.6° |
| C05 | C06 | C10 | H8 | 115.6° | 122.8° |
| C06 | C05 | N04 | C02 | 169.4° | 179.4° |
| C06 | C05 | N04 | C17 | 11.2° | 0.7° |
| C05 | C06 | C10 | C11 | 150.6° | 147.0° |
| C05 | C06 | C10 | O09 | 94.3° | 93.0° |
| C05 | C06 | C10 | C17 | 26.0° | 25.4° |
| C06 | C05 | H6 | H7 | 122.2° | 120.6° |
| C05 | C06 | C07 | H9 | 2.0° | 2.8° |
| C05 | C06 | C07 | H10 | 117.7° | 125.6° |
| N04 | C05 | C06 | C10 | 23.8° | 15.6° |
| C05 | N04 | C02 | O03 | 0.2° | 179.9° |
| C05 | N04 | C02 | C17 | 179.3° | 180.0° |
| C05 | N04 | C02 | C01 | 179.1° | 0.0° |
| C05 | N04 | C17 | C10 | 3.7° | 17.1° |
| C05 | N04 | C17 | H1 | 115.6° | 136.5° |
| C05 | N04 | C17 | H2 | 123.0° | 102.1° |
| N04 | C05 | H6 | H7 | 122.1° | 120.8° |
| N04 | C05 | C06 | H8 | 93.5° | 107.3° |
| C06 | C10 | O09 | C08 | 39.2° | 41.1° |
| C06 | C10 | C17 | N04 | 19.5° | 26.5° |
| C06 | C10 | C11 | C12 | 62.8° | 71.9° |
| C06 | C10 | C11 | O09 | 111.9° | 116.8° |
| C06 | C10 | C11 | C17 | 122.4° | 117.0° |
| C06 | C10 | O09 | C17 | 115.1° | 113.4° |
| C06 | C10 | C17 | H1 | 99.8° | 145.8° |
| C06 | C10 | C17 | H2 | 138.9° | 92.8° |
| C10 | C06 | C05 | H6 | 143.1° | 135.3° |
| C10 | C06 | C05 | H7 | 95.4° | 104.1° |
| C10 | C06 | C07 | H9 | 115.9° | 113.0° |
| C10 | C06 | C07 | H10 | 124.4° | 124.1° |
| C06 | C10 | C11 | H12 | 177.0° | 47.6° |
| C06 | C10 | C11 | H13 | 57.3° | 168.6° |
| C14 | N15 | C16 | C08 | 179.7° | 179.8° |
| N15 | C14 | N13 | H14 | 180.0° | 180.0° |
| C14 | N15 | C16 | C12 | 0.6° | 0.2° |
| N15 | C14 | N13 | C12 | 0.2° | 0.0° |
| N15 | C14 | N13 | H15 | 179.8° | 179.9° |
| N15 | C16 | C08 | C12 | 179.0° | 179.9° |
| N15 | C16 | C08 | O09 | 143.5° | 150.1° |
| C16 | N15 | C14 | N13 | 0.3° | 0.1° |
| N15 | C16 | C12 | N13 | 0.7° | 0.2° |
| N15 | C16 | C12 | C11 | 179.7° | 179.8° |
| N15 | C16 | C08 | H11 | 22.5° | 24.2° |
| C16 | N15 | C14 | H14 | 179.7° | 179.9° |
| C16 | C08 | O09 | H11 | 122.8° | 125.3° |
| C08 | C16 | C12 | N13 | 180.0° | 179.7° |
| C08 | C16 | C12 | C11 | 0.5° | 0.3° |
| C16 | C08 | O09 | C10 | 74.6° | 66.4° |
| C16 | C08 | C07 | H9 | 157.8° | 160.9° |
| C16 | C08 | C07 | H10 | 38.1° | 38.1° |
| O09 | C08 | C16 | C12 | 37.6° | 29.9° |
| C08 | O09 | C10 | C11 | 82.0° | 79.2° |
| C08 | O09 | C10 | C17 | 154.3° | 154.4° |
| O09 | C08 | C07 | H9 | 89.0° | 88.9° |
| O09 | C08 | C07 | H10 | 151.3° | 148.3° |
| C14 | N13 | C12 | C16 | 0.6° | 0.2° |
| C14 | N13 | C12 | H15 | 180.0° | 180.0° |
| C14 | N13 | C12 | C11 | 179.9° | 179.8° |
| C16 | C12 | N13 | C11 | 179.5° | 180.0° |
| C16 | C12 | C11 | C10 | 5.2° | 6.5° |
| C12 | C16 | C08 | H11 | 158.5° | 155.9° |
| C16 | C12 | C11 | H12 | 114.9° | 125.9° |
| C16 | C12 | C11 | H13 | 125.3° | 113.0° |
| C16 | C12 | N13 | H15 | 179.4° | 179.8° |
| O03 | C02 | N04 | C01 | 179.3° | 179.9° |
| O03 | C02 | N04 | C17 | 179.1° | 0.0° |
| O03 | C02 | C01 | H3 | 0.0° | 180.0° |
| O03 | C02 | C01 | H4 | 120.0° | 60.1° |
| O03 | C02 | C01 | H5 | 120.0° | 60.0° |
| N13 | C12 | C11 | C10 | 175.3° | 173.5° |
| N13 | C12 | C11 | H12 | 64.5° | 54.1° |
| N13 | C12 | C11 | H13 | 55.2° | 67.0° |
| C12 | N13 | C14 | H14 | 179.8° | 179.9° |
| C02 | N04 | C17 | C10 | 175.7° | 162.9° |
| C02 | N04 | C17 | H1 | 65.0° | 43.6° |
| C02 | N04 | C17 | H2 | 56.4° | 77.8° |
| N04 | C02 | C01 | H3 | 179.3° | 0.0° |
| N04 | C02 | C01 | H4 | 60.7° | 120.0° |
| N04 | C02 | C01 | H5 | 59.3° | 120.0° |
| C02 | N04 | C05 | H6 | 50.1° | 61.0° |
| C02 | N04 | C05 | H7 | 71.4° | 59.7° |
| C17 | N04 | C02 | C01 | 1.6° | 180.0° |
| N04 | C17 | C10 | C11 | 146.5° | 147.3° |
| N04 | C17 | C10 | O09 | 92.1° | 87.4° |
| N04 | C17 | C10 | H1 | 119.3° | 119.3° |
| N04 | C17 | C10 | H2 | 119.3° | 119.3° |
| N04 | C17 | H1 | H2 | 122.0° | 121.5° |
| C17 | N04 | C05 | H6 | 130.5° | 119.0° |
| C17 | N04 | C05 | H7 | 108.0° | 120.3° |
| C12 | C11 | C10 | H12 | 120.1° | 119.5° |
| C12 | C11 | C10 | H13 | 120.1° | 119.5° |
| C12 | C11 | C10 | O09 | 49.1° | 44.9° |
| C12 | C11 | C10 | C17 | 174.8° | 171.1° |
| C12 | C11 | H12 | H13 | 119.6° | 121.1° |
| C11 | C12 | N13 | H15 | 0.1° | 0.2° |
| C02 | C01 | H3 | H4 | 120.0° | 120.0° |
| C02 | C01 | H3 | H5 | 120.0° | 120.0° |
| C02 | C01 | H4 | H5 | 120.0° | 120.1° |
| C11 | C10 | O09 | C17 | 123.7° | 126.4° |
| C11 | C10 | C17 | H1 | 27.2° | 93.4° |
| C11 | C10 | C17 | H2 | 94.1° | 27.9° |
| C11 | C10 | C06 | H8 | 35.0° | 24.2° |
| C10 | C11 | H12 | H13 | 119.6° | 121.0° |
| O09 | C10 | C17 | H1 | 148.6° | 32.0° |
| O09 | C10 | C17 | H2 | 27.2° | 153.3° |
| O09 | C10 | C06 | H8 | 150.1° | 144.2° |
| C10 | O09 | C08 | H11 | 162.6° | 168.3° |
| O09 | C10 | C11 | H12 | 71.0° | 164.4° |
| O09 | C10 | C11 | H13 | 169.3° | 74.6° |
| C10 | C17 | H1 | H2 | 122.0° | 121.3° |
| C17 | C10 | C06 | H8 | 89.6° | 97.4° |
| C17 | C10 | C11 | H12 | 54.7° | 69.4° |
| C17 | C10 | C11 | H13 | 65.1° | 51.6° |
| H3 | C01 | H4 | H5 | 120.0° | 120.0° |
| H6 | C05 | C06 | H8 | 25.8° | 12.4° |
| H7 | C05 | C06 | H8 | 147.3° | 133.0° |
| H8 | C06 | C07 | H9 | 120.7° | 123.9° |
| H8 | C06 | C07 | H10 | 0.9° | 1.0° |
| H9 | C07 | C08 | H11 | 28.8° | 35.6° |
| H10 | C07 | C08 | H11 | 90.9° | 87.2° |
| H14 | C14 | N13 | H15 | 0.2° | 0.1° |
