RNP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.37Å | 1.39Å | Aromatic |
| C1 | C9 | sing | 1.41Å | 1.48Å | Aromatic |
| C1 | O1 | sing | 1.36Å | 1.37Å | |
| C2 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.10Å | |
| C3 | C4 | doub | 1.36Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.10Å | |
| C4 | C10 | sing | 1.41Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.10Å | |
| C5 | C6 | doub | 1.36Å | 1.40Å | Aromatic |
| C5 | C10 | sing | 1.41Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | doub | 1.36Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.10Å | |
| C8 | C9 | sing | 1.40Å | 1.39Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| C9 | C10 | doub | 1.42Å | 1.48Å | Aromatic |
| O1 | C11 | sing | 1.43Å | 1.45Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | H111 | sing | 1.09Å | 1.11Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C12 | O2 | sing | 1.43Å | 1.43Å | |
| C12 | C13 | sing | 1.51Å | 1.51Å | |
| C12 | H12 | sing | 1.09Å | 1.11Å | |
| O2 | HA | sing | 0.97Å | 0.95Å | |
| C13 | N1 | doub | 1.28Å | 1.34Å | |
| C13 | H13 | sing | 1.08Å | 1.10Å | |
| N1 | C14 | sing | 1.46Å | 1.46Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.53Å | 1.53Å | |
| C14 | H14 | sing | 1.09Å | 1.12Å | |
| C15 | H151 | sing | 1.09Å | 1.12Å | |
| C15 | H152 | sing | 1.09Å | 1.11Å | |
| C15 | H153 | sing | 1.09Å | 1.11Å | |
| C16 | H161 | sing | 1.09Å | 1.12Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C16 | H163 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C9 | 119.9° | 119.5° |
| C2 | C1 | O1 | 123.3° | 120.1° |
| C1 | C2 | C3 | 120.1° | 120.9° |
| C1 | C2 | H2 | 119.9° | 119.6° |
| C9 | C1 | O1 | 116.8° | 120.4° |
| C1 | C9 | C8 | 120.2° | 121.2° |
| C1 | C9 | C10 | 118.0° | 119.4° |
| C1 | O1 | C11 | 119.1° | 106.9° |
| C3 | C2 | H2 | 119.9° | 119.6° |
| C2 | C3 | C4 | 122.2° | 121.1° |
| C2 | C3 | H3 | 118.9° | 119.5° |
| C4 | C3 | H3 | 118.9° | 119.4° |
| C3 | C4 | C10 | 120.9° | 119.8° |
| C3 | C4 | H4 | 119.6° | 120.1° |
| C10 | C4 | H4 | 119.5° | 120.1° |
| C4 | C10 | C5 | 124.0° | 121.2° |
| C4 | C10 | C9 | 118.8° | 119.3° |
| C6 | C5 | C10 | 119.6° | 119.6° |
| C6 | C5 | H5 | 120.2° | 120.2° |
| C5 | C6 | C7 | 122.6° | 121.0° |
| C5 | C6 | H6 | 118.7° | 119.5° |
| C10 | C5 | H5 | 120.2° | 120.2° |
| C5 | C10 | C9 | 117.2° | 119.4° |
| C7 | C6 | H6 | 118.7° | 119.5° |
| C6 | C7 | C8 | 120.1° | 121.0° |
| C6 | C7 | H7 | 120.0° | 119.5° |
| C8 | C7 | H7 | 119.9° | 119.5° |
| C7 | C8 | C9 | 118.8° | 119.6° |
| C7 | C8 | H8 | 120.6° | 120.2° |
| C9 | C8 | H8 | 120.6° | 120.2° |
| C8 | C9 | C10 | 121.8° | 119.4° |
| O1 | C11 | C12 | 112.6° | 109.5° |
| O1 | C11 | H111 | 111.1° | 109.5° |
| O1 | C11 | H112 | 111.1° | 109.5° |
| C12 | C11 | H111 | 111.1° | 109.4° |
| C12 | C11 | H112 | 111.1° | 109.4° |
| C11 | C12 | O2 | 109.8° | 109.5° |
| C11 | C12 | C13 | 109.5° | 109.5° |
| C11 | C12 | H12 | 109.7° | 109.4° |
| H111 | C11 | H112 | 99.3° | 109.4° |
| O2 | C12 | C13 | 108.3° | 109.5° |
| O2 | C12 | H12 | 109.7° | 109.4° |
| C12 | O2 | HA | 109.8° | 106.8° |
| C13 | C12 | H12 | 109.7° | 109.5° |
| C12 | C13 | N1 | 116.7° | 120.0° |
| C12 | C13 | H13 | 121.6° | 120.0° |
| N1 | C13 | H13 | 121.6° | 120.0° |
| C13 | N1 | C14 | 123.4° | 120.1° |
| N1 | C14 | C15 | 108.8° | 109.5° |
| N1 | C14 | C16 | 110.1° | 109.5° |
| N1 | C14 | H14 | 109.7° | 109.4° |
| C15 | C14 | C16 | 108.9° | 109.5° |
| C15 | C14 | H14 | 109.6° | 109.4° |
| C14 | C15 | H151 | 108.8° | 109.5° |
| C14 | C15 | H152 | 112.5° | 109.5° |
| C14 | C15 | H153 | 112.5° | 109.4° |
| C16 | C14 | H14 | 109.6° | 109.4° |
| C14 | C16 | H161 | 110.2° | 109.5° |
| C14 | C16 | H162 | 112.0° | 109.5° |
| C14 | C16 | H163 | 112.0° | 109.5° |
| H151 | C15 | H152 | 112.5° | 109.5° |
| H151 | C15 | H153 | 112.5° | 109.4° |
| H152 | C15 | H153 | 98.0° | 109.5° |
| H161 | C16 | H162 | 111.9° | 109.4° |
| H161 | C16 | H163 | 112.0° | 109.4° |
| H162 | C16 | H163 | 98.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C9 | O1 | 178.8° | 179.8° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.5° | 0.1° |
| C1 | C2 | C3 | H3 | 179.4° | 180.0° |
| C2 | C1 | C9 | C8 | 179.5° | 179.7° |
| C2 | C1 | C9 | C10 | 1.4° | 0.5° |
| C2 | C1 | O1 | C11 | 3.1° | 0.1° |
| C9 | C1 | C2 | C3 | 1.2° | 0.3° |
| C9 | C1 | C2 | H2 | 178.8° | 179.8° |
| C1 | C9 | C10 | C4 | 0.8° | 0.5° |
| C1 | C9 | C10 | C5 | 179.9° | 179.7° |
| C1 | C9 | C8 | C7 | 179.5° | 179.8° |
| C1 | C9 | C8 | C10 | 179.0° | 179.3° |
| C1 | C9 | C8 | H8 | 0.5° | 0.5° |
| C9 | C1 | O1 | C11 | 175.7° | 179.7° |
| O1 | C1 | C2 | C3 | 180.0° | 179.9° |
| O1 | C1 | C2 | H2 | 0.1° | 0.0° |
| O1 | C1 | C9 | C8 | 0.7° | 0.5° |
| O1 | C1 | C9 | C10 | 179.8° | 179.7° |
| C1 | O1 | C11 | C12 | 170.1° | 180.0° |
| C1 | O1 | C11 | H111 | 44.9° | 60.0° |
| C1 | O1 | C11 | H112 | 64.6° | 60.0° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C10 | 0.0° | 0.1° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| H2 | C2 | C3 | C4 | 179.5° | 180.0° |
| H2 | C2 | C3 | H3 | 0.5° | 0.0° |
| C3 | C4 | C10 | H4 | 180.0° | 179.9° |
| C3 | C4 | C10 | C5 | 179.4° | 179.9° |
| C3 | C4 | C10 | C9 | 0.2° | 0.3° |
| H3 | C3 | C4 | C10 | 180.0° | 179.9° |
| H3 | C3 | C4 | H4 | 0.0° | 0.1° |
| C4 | C10 | C5 | C6 | 179.8° | 180.0° |
| C4 | C10 | C5 | C9 | 179.3° | 179.8° |
| C4 | C10 | C5 | H5 | 0.2° | 0.0° |
| C4 | C10 | C9 | C8 | 179.9° | 179.8° |
| H4 | C4 | C10 | C5 | 0.6° | 0.1° |
| H4 | C4 | C10 | C9 | 179.8° | 179.8° |
| C6 | C5 | C10 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 0.5° | 0.0° |
| C5 | C6 | C7 | H7 | 179.5° | 180.0° |
| C6 | C5 | C10 | C9 | 0.5° | 0.2° |
| C10 | C5 | C6 | C7 | 0.1° | 0.0° |
| C10 | C5 | C6 | H6 | 179.9° | 180.0° |
| C5 | C10 | C9 | C8 | 0.8° | 0.5° |
| H5 | C5 | C6 | C7 | 179.9° | 180.0° |
| H5 | C5 | C6 | H6 | 0.1° | 0.0° |
| H5 | C5 | C10 | C9 | 179.5° | 179.8° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.2° | 0.3° |
| C6 | C7 | C8 | H8 | 179.8° | 179.9° |
| H6 | C6 | C7 | C8 | 179.6° | 180.0° |
| H6 | C6 | C7 | H7 | 0.5° | 0.0° |
| C7 | C8 | C9 | H8 | 180.0° | 179.8° |
| C7 | C8 | C9 | C10 | 0.5° | 0.5° |
| H7 | C7 | C8 | C9 | 179.8° | 179.7° |
| H7 | C7 | C8 | H8 | 0.2° | 0.1° |
| H8 | C8 | C9 | C10 | 179.6° | 179.7° |
| O1 | C11 | C12 | H111 | 125.3° | 120.1° |
| O1 | C11 | C12 | H112 | 125.3° | 120.0° |
| O1 | C11 | H111 | H112 | 116.9° | 120.0° |
| O1 | C11 | C12 | O2 | 40.1° | 60.0° |
| O1 | C11 | C12 | C13 | 159.0° | 180.0° |
| O1 | C11 | C12 | H12 | 80.5° | 60.0° |
| C12 | C11 | H111 | H112 | 117.0° | 119.9° |
| C11 | C12 | O2 | C13 | 119.6° | 120.0° |
| C11 | C12 | O2 | H12 | 120.7° | 119.9° |
| C11 | C12 | C13 | H12 | 120.5° | 120.0° |
| C11 | C12 | O2 | HA | 180.0° | 60.0° |
| C11 | C12 | C13 | N1 | 158.0° | 120.0° |
| C11 | C12 | C13 | H13 | 22.0° | 60.0° |
| H111 | C11 | C12 | O2 | 85.1° | 60.1° |
| H111 | C11 | C12 | C13 | 33.8° | 59.9° |
| H111 | C11 | C12 | H12 | 154.2° | 180.0° |
| H112 | C11 | C12 | O2 | 165.4° | 180.0° |
| H112 | C11 | C12 | C13 | 75.7° | 60.0° |
| H112 | C11 | C12 | H12 | 44.7° | 60.1° |
| O2 | C12 | C13 | H12 | 119.7° | 120.0° |
| O2 | C12 | C13 | N1 | 82.2° | 0.0° |
| O2 | C12 | C13 | H13 | 97.8° | 180.0° |
| C13 | C12 | O2 | HA | 60.4° | 60.0° |
| C12 | C13 | N1 | H13 | 180.0° | 179.9° |
| C12 | C13 | N1 | C14 | 29.9° | 180.0° |
| H12 | C12 | O2 | HA | 59.3° | 179.9° |
| H12 | C12 | C13 | N1 | 37.5° | 119.9° |
| H12 | C12 | C13 | H13 | 142.5° | 60.0° |
| C13 | N1 | C14 | C15 | 145.1° | 119.9° |
| C13 | N1 | C14 | C16 | 95.5° | 120.0° |
| C13 | N1 | C14 | H14 | 25.2° | 0.1° |
| H13 | C13 | N1 | C14 | 150.1° | 0.1° |
| N1 | C14 | C15 | C16 | 120.1° | 120.1° |
| N1 | C14 | C15 | H14 | 119.9° | 119.9° |
| N1 | C14 | C16 | H14 | 120.8° | 119.9° |
| N1 | C14 | C15 | H151 | 180.0° | 180.0° |
| N1 | C14 | C15 | H152 | 54.7° | 59.9° |
| N1 | C14 | C15 | H153 | 54.7° | 60.1° |
| N1 | C14 | C16 | H161 | 180.0° | 60.1° |
| N1 | C14 | C16 | H162 | 54.7° | 59.9° |
| N1 | C14 | C16 | H163 | 54.7° | 179.9° |
| C15 | C14 | C16 | H14 | 120.0° | 120.0° |
| C14 | C15 | H151 | H152 | 125.3° | 120.1° |
| C14 | C15 | H151 | H153 | 125.3° | 120.0° |
| C14 | C15 | H152 | H153 | 118.4° | 120.0° |
| C15 | C14 | C16 | H161 | 60.8° | 60.1° |
| C15 | C14 | C16 | H162 | 174.0° | 180.0° |
| C15 | C14 | C16 | H163 | 64.5° | 59.9° |
| C16 | C14 | C15 | H151 | 59.9° | 59.9° |
| C16 | C14 | C15 | H152 | 65.4° | 180.0° |
| C16 | C14 | C15 | H153 | 174.8° | 60.0° |
| C14 | C16 | H161 | H162 | 125.2° | 120.0° |
| C14 | C16 | H161 | H163 | 125.3° | 120.1° |
| C14 | C16 | H162 | H163 | 117.9° | 120.1° |
| H14 | C14 | C15 | H151 | 60.1° | 60.0° |
| H14 | C14 | C15 | H152 | 174.7° | 60.0° |
| H14 | C14 | C15 | H153 | 65.2° | 180.0° |
| H14 | C14 | C16 | H161 | 59.2° | 180.0° |
| H14 | C14 | C16 | H162 | 66.0° | 60.0° |
| H14 | C14 | C16 | H163 | 175.5° | 60.0° |
| H151 | C15 | H152 | H153 | 118.4° | 120.0° |
| H161 | C16 | H162 | H163 | 117.9° | 119.9° |
