6LP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CLAV | CAT | sing | 1.74Å | 1.72Å | |
| CAT | CAS | doub | 1.38Å | 1.40Å | Aromatic |
| CAT | CAU | sing | 1.38Å | 1.40Å | Aromatic |
| CAS | CAR | sing | 1.38Å | 1.40Å | Aromatic |
| CAU | CAP | doub | 1.39Å | 1.40Å | Aromatic |
| CAR | CAQ | doub | 1.38Å | 1.40Å | Aromatic |
| CAP | CAQ | sing | 1.39Å | 1.41Å | Aromatic |
| CAP | NAO | sing | 1.40Å | 1.34Å | |
| C6 | N1 | doub | 1.32Å | 1.41Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| N1 | C2 | sing | 1.33Å | 1.35Å | Aromatic |
| CAG | CAH | doub | 1.38Å | 1.39Å | Aromatic |
| CAG | CAF | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| C2 | NAO | sing | 1.39Å | 1.34Å | |
| C2 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| CAH | NAI | sing | 1.32Å | 1.41Å | Aromatic |
| C4 | N3 | sing | 1.33Å | 1.35Å | Aromatic |
| C4 | CAF | sing | 1.48Å | 1.40Å | |
| CAF | CAE | doub | 1.39Å | 1.40Å | Aromatic |
| NAI | CAD | doub | 1.32Å | 1.35Å | Aromatic |
| NAX | CAA | sing | 1.47Å | 1.47Å | |
| CAE | CAD | sing | 1.39Å | 1.40Å | Aromatic |
| CAD | NAC | sing | 1.39Å | 1.33Å | |
| CAB | CAA | sing | 1.53Å | 1.53Å | |
| CAB | NAC | sing | 1.46Å | 1.47Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| CAU | H3 | sing | 1.08Å | 1.08Å | |
| CAS | H4 | sing | 1.08Å | 1.08Å | |
| CAR | H5 | sing | 1.08Å | 1.08Å | |
| CAQ | H6 | sing | 1.08Å | 1.08Å | |
| NAO | H7 | sing | 0.97Å | 1.00Å | |
| CAE | H8 | sing | 1.08Å | 1.08Å | |
| CAG | H9 | sing | 1.08Å | 1.08Å | |
| CAH | H10 | sing | 1.08Å | 1.08Å | |
| NAC | H11 | sing | 0.97Å | 1.00Å | |
| CAB | H12 | sing | 1.09Å | 1.10Å | |
| CAB | H13 | sing | 1.09Å | 1.10Å | |
| CAA | H14 | sing | 1.09Å | 1.10Å | |
| CAA | H15 | sing | 1.09Å | 1.10Å | |
| NAX | H16 | sing | 1.01Å | 1.00Å | |
| NAX | H17 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CLAV | CAT | CAS | 119.6° | 120.0° |
| CLAV | CAT | CAU | 120.1° | 120.0° |
| CAS | CAT | CAU | 120.3° | 120.1° |
| CAT | CAS | CAR | 120.0° | 120.1° |
| CAT | CAS | H4 | 120.0° | 120.0° |
| CAT | CAU | CAP | 120.0° | 119.9° |
| CAT | CAU | H3 | 120.0° | 120.0° |
| CAS | CAR | CAQ | 119.7° | 120.1° |
| CAR | CAS | H4 | 120.0° | 119.9° |
| CAS | CAR | H5 | 120.1° | 120.0° |
| CAU | CAP | CAQ | 119.4° | 119.9° |
| CAU | CAP | NAO | 119.8° | 120.0° |
| CAP | CAU | H3 | 120.0° | 120.1° |
| CAR | CAQ | CAP | 120.5° | 119.9° |
| CAQ | CAR | H5 | 120.2° | 119.9° |
| CAR | CAQ | H6 | 119.7° | 120.1° |
| CAQ | CAP | NAO | 120.7° | 120.0° |
| CAP | CAQ | H6 | 119.7° | 120.0° |
| CAP | NAO | C2 | 118.9° | 120.0° |
| CAP | NAO | H7 | 120.6° | 120.0° |
| N1 | C6 | C5 | 119.3° | 119.3° |
| C6 | N1 | C2 | 119.9° | 121.0° |
| N1 | C6 | H2 | 120.3° | 120.3° |
| C6 | C5 | C4 | 118.6° | 118.4° |
| C6 | C5 | H1 | 120.7° | 120.8° |
| C5 | C6 | H2 | 120.4° | 120.4° |
| N1 | C2 | NAO | 120.1° | 119.2° |
| N1 | C2 | N3 | 119.9° | 121.7° |
| CAH | CAG | CAF | 119.9° | 119.2° |
| CAG | CAH | NAI | 119.8° | 121.0° |
| CAH | CAG | H9 | 120.0° | 120.4° |
| CAG | CAH | H10 | 120.1° | 119.5° |
| CAG | CAF | C4 | 118.7° | 120.8° |
| CAG | CAF | CAE | 119.0° | 118.3° |
| CAF | CAG | H9 | 120.1° | 120.5° |
| C5 | C4 | N3 | 119.3° | 119.0° |
| C5 | C4 | CAF | 121.9° | 120.5° |
| C4 | C5 | H1 | 120.7° | 120.8° |
| NAO | C2 | N3 | 119.9° | 119.2° |
| C2 | NAO | H7 | 120.5° | 120.1° |
| C2 | N3 | C4 | 122.9° | 120.6° |
| CAH | NAI | CAD | 120.8° | 121.9° |
| NAI | CAH | H10 | 120.1° | 119.5° |
| N3 | C4 | CAF | 118.8° | 120.5° |
| C4 | CAF | CAE | 122.1° | 120.9° |
| CAF | CAE | CAD | 120.4° | 119.0° |
| CAF | CAE | H8 | 119.8° | 120.5° |
| NAI | CAD | CAE | 120.0° | 120.7° |
| NAI | CAD | NAC | 119.9° | 119.6° |
| NAX | CAA | CAB | 110.7° | 109.5° |
| NAX | CAA | H14 | 109.2° | 109.4° |
| NAX | CAA | H15 | 109.1° | 109.5° |
| CAA | NAX | H16 | 109.5° | 111.0° |
| CAA | NAX | H17 | 109.4° | 111.0° |
| CAE | CAD | NAC | 120.1° | 119.7° |
| CAD | CAE | H8 | 119.8° | 120.5° |
| CAD | NAC | CAB | 123.1° | 120.0° |
| CAD | NAC | H11 | 106.0° | 120.0° |
| CAA | CAB | NAC | 110.1° | 109.5° |
| CAA | CAB | H12 | 109.3° | 109.5° |
| CAA | CAB | H13 | 109.4° | 109.5° |
| CAB | CAA | H14 | 109.2° | 109.4° |
| CAB | CAA | H15 | 109.2° | 109.5° |
| CAB | NAC | H11 | 105.9° | 120.0° |
| NAC | CAB | H12 | 109.3° | 109.5° |
| NAC | CAB | H13 | 109.3° | 109.5° |
| H12 | CAB | H13 | 109.4° | 109.4° |
| H14 | CAA | H15 | 109.5° | 109.5° |
| H16 | NAX | H17 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CLAV | CAT | CAS | CAU | 179.8° | 180.0° |
| CLAV | CAT | CAS | CAR | 179.9° | 180.0° |
| CLAV | CAT | CAU | CAP | 179.3° | 179.9° |
| CLAV | CAT | CAU | H3 | 0.7° | 0.3° |
| CLAV | CAT | CAS | H4 | 0.1° | 0.0° |
| CAT | CAS | CAR | H4 | 180.0° | 180.0° |
| CAS | CAT | CAU | CAP | 0.9° | 0.1° |
| CAT | CAS | CAR | CAQ | 0.8° | 0.0° |
| CAS | CAT | CAU | H3 | 179.2° | 179.7° |
| CAT | CAS | CAR | H5 | 179.2° | 180.0° |
| CAU | CAT | CAS | CAR | 0.3° | 0.0° |
| CAT | CAU | CAP | H3 | 180.0° | 179.6° |
| CAT | CAU | CAP | CAQ | 1.9° | 0.1° |
| CAT | CAU | CAP | NAO | 179.1° | 179.7° |
| CAU | CAT | CAS | H4 | 179.7° | 180.0° |
| CAS | CAR | CAQ | H5 | 180.0° | 179.9° |
| CAS | CAR | CAQ | CAP | 1.8° | 0.0° |
| CAS | CAR | CAQ | H6 | 178.2° | 180.0° |
| CAU | CAP | CAQ | CAR | 2.4° | 0.1° |
| CAU | CAP | CAQ | NAO | 177.2° | 179.8° |
| CAU | CAP | NAO | C2 | 101.9° | 146.6° |
| CAU | CAP | CAQ | H6 | 177.6° | 179.9° |
| CAU | CAP | NAO | H7 | 78.1° | 33.4° |
| CAR | CAQ | CAP | H6 | 180.0° | 180.0° |
| CAR | CAQ | CAP | NAO | 179.6° | 179.7° |
| CAQ | CAR | CAS | H4 | 179.2° | 180.0° |
| CAQ | CAP | NAO | C2 | 80.9° | 33.5° |
| CAQ | CAP | CAU | H3 | 178.1° | 179.7° |
| CAP | CAQ | CAR | H5 | 178.2° | 180.0° |
| CAQ | CAP | NAO | H7 | 99.1° | 146.4° |
| CAP | NAO | C2 | N1 | 129.9° | 5.6° |
| CAP | NAO | C2 | H7 | 180.0° | 179.9° |
| CAP | NAO | C2 | N3 | 53.0° | 174.4° |
| NAO | CAP | CAU | H3 | 0.9° | 0.1° |
| NAO | CAP | CAQ | H6 | 0.4° | 0.2° |
| N1 | C6 | C5 | H2 | 180.0° | 180.0° |
| N1 | C6 | C5 | C4 | 1.4° | 0.0° |
| C6 | N1 | C2 | NAO | 179.0° | 180.0° |
| C6 | N1 | C2 | N3 | 1.8° | 0.1° |
| N1 | C6 | C5 | H1 | 178.6° | 180.0° |
| C5 | C6 | N1 | C2 | 0.2° | 0.1° |
| C6 | C5 | C4 | H1 | 180.0° | 180.0° |
| C6 | C5 | C4 | N3 | 1.5° | 0.0° |
| C6 | C5 | C4 | CAF | 179.6° | 179.7° |
| N1 | C2 | NAO | N3 | 177.2° | 179.9° |
| N1 | C2 | N3 | C4 | 1.8° | 0.1° |
| C2 | N1 | C6 | H2 | 179.8° | 180.0° |
| N1 | C2 | NAO | H7 | 50.1° | 174.5° |
| CAH | CAG | CAF | H9 | 180.0° | 179.9° |
| CAG | CAH | NAI | H10 | 180.0° | 180.0° |
| CAH | CAG | CAF | C4 | 178.4° | 180.0° |
| CAH | CAG | CAF | CAE | 2.3° | 0.2° |
| CAG | CAH | NAI | CAD | 0.1° | 0.3° |
| CAG | CAF | C4 | C5 | 140.5° | 0.0° |
| CAF | CAG | CAH | NAI | 0.4° | 0.0° |
| CAG | CAF | C4 | N3 | 37.6° | 179.8° |
| CAG | CAF | C4 | CAE | 176.0° | 179.8° |
| CAG | CAF | CAE | CAD | 4.0° | 0.2° |
| CAG | CAF | CAE | H8 | 176.0° | 179.8° |
| CAF | CAG | CAH | H10 | 179.6° | 179.9° |
| C5 | C4 | N3 | C2 | 0.1° | 0.0° |
| C5 | C4 | N3 | CAF | 178.2° | 179.7° |
| C5 | C4 | CAF | CAE | 43.5° | 179.7° |
| C4 | C5 | C6 | H2 | 178.6° | 180.0° |
| NAO | C2 | N3 | C4 | 179.0° | 180.0° |
| C2 | N3 | C4 | CAF | 178.0° | 179.7° |
| N3 | C2 | NAO | H7 | 127.0° | 5.6° |
| CAH | NAI | CAD | CAE | 1.8° | 0.2° |
| CAH | NAI | CAD | NAC | 178.9° | 179.7° |
| NAI | CAH | CAG | H9 | 179.6° | 179.9° |
| N3 | C4 | CAF | CAE | 138.4° | 0.0° |
| N3 | C4 | C5 | H1 | 178.5° | 180.0° |
| C4 | CAF | CAE | CAD | 180.0° | 180.0° |
| CAF | C4 | C5 | H1 | 0.4° | 0.3° |
| C4 | CAF | CAE | H8 | 0.0° | 0.0° |
| C4 | CAF | CAG | H9 | 1.6° | 0.1° |
| CAF | CAE | CAD | NAI | 3.8° | 0.0° |
| CAF | CAE | CAD | H8 | 180.0° | 180.0° |
| CAF | CAE | CAD | NAC | 179.1° | 180.0° |
| CAE | CAF | CAG | H9 | 177.7° | 179.7° |
| NAI | CAD | CAE | NAC | 177.1° | 179.9° |
| NAI | CAD | NAC | CAB | 62.3° | 180.0° |
| NAI | CAD | CAE | H8 | 176.2° | 180.0° |
| CAD | NAI | CAH | H10 | 179.9° | 179.7° |
| NAI | CAD | NAC | H11 | 175.8° | 0.0° |
| NAX | CAA | CAB | H14 | 120.2° | 119.9° |
| NAX | CAA | CAB | H15 | 120.2° | 120.1° |
| NAX | CAA | CAB | NAC | 145.0° | 179.9° |
| NAX | CAA | CAB | H12 | 24.9° | 60.0° |
| NAX | CAA | CAB | H13 | 94.9° | 59.9° |
| NAX | CAA | H14 | H15 | 119.4° | 120.1° |
| CAA | NAX | H16 | H17 | 120.0° | 124.0° |
| CAE | CAD | NAC | CAB | 120.6° | 0.1° |
| CAE | CAD | NAC | H11 | 1.3° | 180.0° |
| CAD | NAC | CAB | CAA | 133.9° | 180.0° |
| CAD | NAC | CAB | H11 | 121.9° | 179.9° |
| NAC | CAD | CAE | H8 | 0.9° | 0.1° |
| CAD | NAC | CAB | H12 | 13.8° | 59.9° |
| CAD | NAC | CAB | H13 | 106.0° | 60.0° |
| CAA | CAB | NAC | H12 | 120.1° | 120.0° |
| CAA | CAB | NAC | H13 | 120.1° | 120.0° |
| CAA | CAB | NAC | H11 | 12.0° | 0.0° |
| CAA | CAB | H12 | H13 | 119.8° | 120.0° |
| CAB | CAA | H14 | H15 | 119.5° | 120.0° |
| CAB | CAA | NAX | H16 | 180.0° | 56.0° |
| CAB | CAA | NAX | H17 | 60.0° | 180.0° |
| NAC | CAB | H12 | H13 | 119.7° | 120.0° |
| NAC | CAB | CAA | H14 | 94.8° | 60.0° |
| NAC | CAB | CAA | H15 | 24.8° | 60.0° |
| H1 | C5 | C6 | H2 | 1.4° | 0.0° |
| H4 | CAS | CAR | H5 | 0.8° | 0.0° |
| H5 | CAR | CAQ | H6 | 1.8° | 0.0° |
| H9 | CAG | CAH | H10 | 0.4° | 0.0° |
| H11 | NAC | CAB | H12 | 108.1° | 120.0° |
| H11 | NAC | CAB | H13 | 132.1° | 120.0° |
| H12 | CAB | CAA | H14 | 145.1° | 179.9° |
| H12 | CAB | CAA | H15 | 95.3° | 60.1° |
| H13 | CAB | CAA | H14 | 25.3° | 60.0° |
| H13 | CAB | CAA | H15 | 144.9° | 180.0° |
| H14 | CAA | NAX | H16 | 59.8° | 63.9° |
| H14 | CAA | NAX | H17 | 60.2° | 60.1° |
| H15 | CAA | NAX | H16 | 59.8° | 176.0° |
| H15 | CAA | NAX | H17 | 179.8° | 60.0° |
