RIX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C09 | C08 | doub | 1.34Å | 1.50Å | Aromatic |
| C09 | C10 | sing | 1.47Å | 1.53Å | Aromatic |
| C08 | N07 | sing | 1.37Å | 1.46Å | Aromatic |
| CL16 | C11 | sing | 1.74Å | 1.75Å | |
| C01 | O02 | sing | 1.45Å | 1.40Å | |
| O04 | C03 | doub | 1.21Å | 1.17Å | |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.41Å | 1.38Å | Aromatic |
| C03 | O02 | sing | 1.35Å | 1.39Å | |
| C03 | C05 | sing | 1.49Å | 1.50Å | |
| N07 | C15 | sing | 1.38Å | 1.47Å | Aromatic |
| N07 | C05 | sing | 1.35Å | 1.43Å | |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.39Å | 1.41Å | Aromatic |
| C05 | O06 | doub | 1.21Å | 1.18Å | |
| C12 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C08 | H4 | sing | 1.08Å | 1.08Å | |
| C09 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C08 | C09 | C10 | 105.6° | 107.1° |
| C09 | C08 | N07 | 105.2° | 109.9° |
| C09 | C08 | H4 | 127.4° | 125.0° |
| C08 | C09 | H5 | 127.2° | 126.4° |
| C09 | C10 | C11 | 130.7° | 133.9° |
| C09 | C10 | C15 | 110.8° | 106.1° |
| C10 | C09 | H5 | 127.2° | 126.4° |
| C08 | N07 | C15 | 111.3° | 109.7° |
| C08 | N07 | C05 | 124.9° | 125.2° |
| N07 | C08 | H4 | 127.4° | 125.1° |
| CL16 | C11 | C10 | 114.7° | 120.2° |
| CL16 | C11 | C12 | 122.5° | 120.2° |
| C01 | O02 | C03 | 113.7° | 117.0° |
| O02 | C01 | H1 | 109.5° | 109.4° |
| O02 | C01 | H2 | 109.5° | 109.4° |
| O02 | C01 | H3 | 109.4° | 109.5° |
| O04 | C03 | O02 | 121.9° | 120.0° |
| O04 | C03 | C05 | 117.9° | 120.0° |
| C11 | C10 | C15 | 118.5° | 120.0° |
| C10 | C11 | C12 | 122.8° | 119.6° |
| C10 | C15 | N07 | 107.1° | 107.1° |
| C10 | C15 | C14 | 120.4° | 119.5° |
| O02 | C03 | C05 | 120.2° | 120.0° |
| C03 | C05 | N07 | 118.1° | 120.0° |
| C03 | C05 | O06 | 120.5° | 120.0° |
| C15 | N07 | C05 | 123.7° | 125.1° |
| N07 | C15 | C14 | 132.5° | 133.4° |
| N07 | C05 | O06 | 121.4° | 120.0° |
| C11 | C12 | C13 | 118.6° | 120.3° |
| C11 | C12 | H6 | 120.7° | 119.9° |
| C15 | C14 | C13 | 120.1° | 119.9° |
| C15 | C14 | H8 | 119.9° | 120.0° |
| C12 | C13 | C14 | 119.7° | 120.6° |
| C13 | C12 | H6 | 120.8° | 119.8° |
| C12 | C13 | H7 | 120.2° | 119.7° |
| C14 | C13 | H7 | 120.2° | 119.7° |
| C13 | C14 | H8 | 120.0° | 120.0° |
| H1 | C01 | H2 | 109.4° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C08 | C09 | C10 | H5 | 180.0° | 180.0° |
| C09 | C08 | N07 | H4 | 180.0° | 179.8° |
| C08 | C09 | C10 | C11 | 179.7° | 179.9° |
| C08 | C09 | C10 | C15 | 0.6° | 0.0° |
| C09 | C08 | N07 | C15 | 0.4° | 0.0° |
| C09 | C08 | N07 | C05 | 176.7° | 179.8° |
| C10 | C09 | C08 | N07 | 0.1° | 0.0° |
| C09 | C10 | C11 | CL16 | 0.6° | 0.1° |
| C09 | C10 | C11 | C15 | 179.6° | 179.9° |
| C09 | C10 | C15 | N07 | 0.9° | 0.0° |
| C09 | C10 | C11 | C12 | 179.3° | 180.0° |
| C09 | C10 | C15 | C14 | 179.3° | 180.0° |
| C10 | C09 | C08 | H4 | 179.9° | 179.8° |
| C08 | N07 | C15 | C10 | 0.8° | 0.0° |
| C08 | N07 | C05 | C03 | 2.5° | 0.0° |
| C08 | N07 | C15 | C05 | 177.1° | 179.7° |
| C08 | N07 | C15 | C14 | 179.0° | 180.0° |
| C08 | N07 | C05 | O06 | 179.2° | 179.9° |
| N07 | C08 | C09 | H5 | 179.9° | 180.0° |
| CL16 | C11 | C10 | C12 | 178.7° | 179.9° |
| CL16 | C11 | C10 | C15 | 179.7° | 180.0° |
| CL16 | C11 | C12 | C13 | 179.3° | 180.0° |
| CL16 | C11 | C12 | H6 | 0.7° | 0.1° |
| C01 | O02 | C03 | O04 | 14.2° | 0.1° |
| C01 | O02 | C03 | C05 | 168.1° | 180.0° |
| O02 | C01 | H1 | H2 | 120.0° | 119.9° |
| O02 | C01 | H1 | H3 | 120.0° | 120.1° |
| O02 | C01 | H2 | H3 | 120.0° | 120.1° |
| O04 | C03 | O02 | C05 | 177.7° | 179.9° |
| O04 | C03 | C05 | N07 | 127.9° | 0.0° |
| O04 | C03 | C05 | O06 | 50.3° | 179.9° |
| C11 | C10 | C15 | N07 | 179.4° | 180.0° |
| C11 | C10 | C15 | C14 | 1.0° | 0.1° |
| C10 | C11 | C12 | C13 | 0.8° | 0.1° |
| C11 | C10 | C09 | H5 | 0.3° | 0.1° |
| C10 | C11 | C12 | H6 | 179.2° | 180.0° |
| C10 | C15 | N07 | C14 | 178.2° | 179.9° |
| C10 | C15 | N07 | C05 | 176.3° | 179.8° |
| C15 | C10 | C11 | C12 | 1.0° | 0.1° |
| C10 | C15 | C14 | C13 | 0.7° | 0.1° |
| C15 | C10 | C09 | H5 | 179.3° | 180.0° |
| C10 | C15 | C14 | H8 | 179.4° | 179.9° |
| O02 | C03 | C05 | N07 | 54.3° | 180.0° |
| O02 | C03 | C05 | O06 | 127.5° | 0.0° |
| C03 | O02 | C01 | H1 | 180.0° | 180.0° |
| C03 | O02 | C01 | H2 | 60.0° | 60.1° |
| C03 | O02 | C01 | H3 | 60.0° | 60.0° |
| C03 | C05 | N07 | C15 | 179.2° | 179.7° |
| C03 | C05 | N07 | O06 | 178.3° | 180.0° |
| C15 | N07 | C05 | O06 | 2.5° | 0.3° |
| N07 | C15 | C14 | C13 | 178.7° | 180.0° |
| C15 | N07 | C08 | H4 | 179.6° | 179.7° |
| N07 | C15 | C14 | H8 | 1.3° | 0.0° |
| C05 | N07 | C15 | C14 | 1.9° | 0.3° |
| C05 | N07 | C08 | H4 | 3.3° | 0.0° |
| C11 | C12 | C13 | H6 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.4° | 0.1° |
| C11 | C12 | C13 | H7 | 179.6° | 180.0° |
| C15 | C14 | C13 | C12 | 0.4° | 0.1° |
| C15 | C14 | C13 | H8 | 180.0° | 180.0° |
| C15 | C14 | C13 | H7 | 179.6° | 180.0° |
| C12 | C13 | C14 | H7 | 180.0° | 179.9° |
| C12 | C13 | C14 | H8 | 179.6° | 179.9° |
| C14 | C13 | C12 | H6 | 179.6° | 180.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H4 | C08 | C09 | H5 | 0.1° | 0.3° |
| H6 | C12 | C13 | H7 | 0.4° | 0.1° |
| H7 | C13 | C14 | H8 | 0.3° | 0.0° |
