16V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAM | NAL | sing | 1.40Å | 1.35Å | Aromatic |
| NAM | CAQ | doub | 1.31Å | 1.34Å | Aromatic |
| NAL | CAP | sing | 1.35Å | 1.33Å | Aromatic |
| CAQ | CAB | sing | 1.51Å | 1.54Å | |
| CAQ | CAU | sing | 1.40Å | 1.37Å | Aromatic |
| CAP | CAA | sing | 1.51Å | 1.54Å | |
| CAP | CAU | doub | 1.35Å | 1.36Å | Aromatic |
| CAU | CAK | sing | 1.51Å | 1.60Å | |
| CAK | CAI | sing | 1.53Å | 1.52Å | |
| CAI | CAJ | sing | 1.53Å | 1.51Å | |
| CAJ | OAN | sing | 1.43Å | 1.43Å | |
| OAN | CAT | sing | 1.36Å | 1.37Å | |
| FAE | CAR | sing | 1.35Å | 1.36Å | |
| CAT | CAR | doub | 1.39Å | 1.40Å | Aromatic |
| CAT | CAH | sing | 1.38Å | 1.39Å | Aromatic |
| CAR | CAF | sing | 1.39Å | 1.39Å | Aromatic |
| CAH | CAS | doub | 1.40Å | 1.39Å | Aromatic |
| CAF | CAG | doub | 1.38Å | 1.39Å | Aromatic |
| CAS | CAG | sing | 1.40Å | 1.41Å | Aromatic |
| CAS | CAO | sing | 1.48Å | 1.41Å | |
| OAC | CAO | doub | 1.21Å | 1.25Å | |
| CAO | OAD | sing | 1.35Å | 1.25Å | |
| OAD | H1 | sing | 0.97Å | 0.95Å | |
| CAH | H2 | sing | 1.08Å | 1.08Å | |
| CAG | H3 | sing | 1.08Å | 1.08Å | |
| CAF | H4 | sing | 1.08Å | 1.08Å | |
| CAJ | H5 | sing | 1.09Å | 1.10Å | |
| CAJ | H6 | sing | 1.09Å | 1.10Å | |
| CAI | H7 | sing | 1.09Å | 1.10Å | |
| CAI | H8 | sing | 1.09Å | 1.10Å | |
| CAK | H9 | sing | 1.09Å | 1.10Å | |
| CAK | H10 | sing | 1.09Å | 1.10Å | |
| CAA | H11 | sing | 1.09Å | 1.10Å | |
| CAA | H12 | sing | 1.09Å | 1.10Å | |
| CAA | H13 | sing | 1.09Å | 1.10Å | |
| NAL | H14 | sing | 0.97Å | 1.00Å | |
| CAB | H15 | sing | 1.09Å | 1.10Å | |
| CAB | H16 | sing | 1.09Å | 1.10Å | |
| CAB | H17 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAL | NAM | CAQ | 108.3° | 108.2° |
| NAM | NAL | CAP | 107.8° | 107.9° |
| NAM | NAL | H14 | 126.1° | 126.0° |
| NAM | CAQ | CAB | 121.9° | 125.9° |
| NAM | CAQ | CAU | 108.7° | 108.2° |
| NAL | CAP | CAA | 122.4° | 126.1° |
| NAL | CAP | CAU | 109.5° | 107.7° |
| CAP | NAL | H14 | 126.1° | 126.0° |
| CAB | CAQ | CAU | 129.3° | 125.9° |
| CAQ | CAB | H15 | 109.5° | 109.4° |
| CAQ | CAB | H16 | 109.4° | 109.5° |
| CAQ | CAB | H17 | 109.5° | 109.5° |
| CAQ | CAU | CAP | 105.7° | 107.9° |
| CAQ | CAU | CAK | 130.8° | 126.1° |
| CAA | CAP | CAU | 128.1° | 126.1° |
| CAP | CAA | H11 | 109.5° | 109.5° |
| CAP | CAA | H12 | 109.5° | 109.5° |
| CAP | CAA | H13 | 109.5° | 109.5° |
| CAP | CAU | CAK | 123.5° | 126.0° |
| CAU | CAK | CAI | 117.2° | 109.5° |
| CAU | CAK | H9 | 107.5° | 109.5° |
| CAU | CAK | H10 | 107.5° | 109.5° |
| CAK | CAI | CAJ | 111.5° | 109.5° |
| CAK | CAI | H7 | 109.0° | 109.4° |
| CAK | CAI | H8 | 108.9° | 109.4° |
| CAI | CAK | H9 | 107.5° | 109.5° |
| CAI | CAK | H10 | 107.5° | 109.4° |
| CAI | CAJ | OAN | 114.0° | 109.4° |
| CAI | CAJ | H5 | 108.3° | 109.5° |
| CAI | CAJ | H6 | 108.3° | 109.5° |
| CAJ | CAI | H7 | 108.9° | 109.5° |
| CAJ | CAI | H8 | 109.0° | 109.5° |
| CAJ | OAN | CAT | 110.5° | 117.0° |
| OAN | CAJ | H5 | 108.3° | 109.5° |
| OAN | CAJ | H6 | 108.4° | 109.4° |
| OAN | CAT | CAR | 116.7° | 120.0° |
| OAN | CAT | CAH | 124.0° | 120.0° |
| FAE | CAR | CAT | 121.8° | 119.9° |
| FAE | CAR | CAF | 117.7° | 119.9° |
| CAR | CAT | CAH | 119.3° | 120.0° |
| CAT | CAR | CAF | 120.5° | 120.2° |
| CAT | CAH | CAS | 121.5° | 119.8° |
| CAT | CAH | H2 | 119.2° | 120.1° |
| CAR | CAF | CAG | 119.2° | 120.2° |
| CAR | CAF | H4 | 120.4° | 120.0° |
| CAH | CAS | CAG | 118.4° | 119.8° |
| CAH | CAS | CAO | 118.4° | 120.1° |
| CAS | CAH | H2 | 119.3° | 120.1° |
| CAF | CAG | CAS | 121.1° | 120.0° |
| CAF | CAG | H3 | 119.4° | 120.1° |
| CAG | CAF | H4 | 120.4° | 119.9° |
| CAG | CAS | CAO | 123.2° | 120.1° |
| CAS | CAG | H3 | 119.5° | 120.0° |
| CAS | CAO | OAC | 120.2° | 120.0° |
| CAS | CAO | OAD | 121.3° | 120.0° |
| OAC | CAO | OAD | 118.5° | 120.0° |
| CAO | OAD | H1 | 109.5° | 117.0° |
| H5 | CAJ | H6 | 109.5° | 109.5° |
| H7 | CAI | H8 | 109.5° | 109.5° |
| H9 | CAK | H10 | 109.5° | 109.4° |
| H11 | CAA | H12 | 109.5° | 109.5° |
| H11 | CAA | H13 | 109.4° | 109.4° |
| H12 | CAA | H13 | 109.5° | 109.4° |
| H15 | CAB | H16 | 109.5° | 109.4° |
| H15 | CAB | H17 | 109.4° | 109.5° |
| H16 | CAB | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAM | NAL | CAP | H14 | 180.0° | 179.9° |
| NAL | NAM | CAQ | CAB | 179.5° | 180.0° |
| NAL | NAM | CAQ | CAU | 0.3° | 0.5° |
| NAM | NAL | CAP | CAA | 179.5° | 180.0° |
| NAM | NAL | CAP | CAU | 0.4° | 0.0° |
| CAQ | NAM | NAL | CAP | 0.4° | 0.3° |
| NAM | CAQ | CAB | CAU | 179.8° | 179.4° |
| NAM | CAQ | CAU | CAP | 0.1° | 0.5° |
| NAM | CAQ | CAU | CAK | 179.6° | 179.8° |
| CAQ | NAM | NAL | H14 | 179.6° | 179.7° |
| NAM | CAQ | CAB | H15 | 0.0° | 90.1° |
| NAM | CAQ | CAB | H16 | 120.0° | 150.0° |
| NAM | CAQ | CAB | H17 | 120.0° | 30.0° |
| NAL | CAP | CAU | CAQ | 0.2° | 0.3° |
| NAL | CAP | CAA | CAU | 178.9° | 180.0° |
| NAL | CAP | CAU | CAK | 179.9° | 180.0° |
| NAL | CAP | CAA | H11 | 90.5° | 90.0° |
| NAL | CAP | CAA | H12 | 149.5° | 30.1° |
| NAL | CAP | CAA | H13 | 29.5° | 150.0° |
| CAB | CAQ | CAU | CAP | 179.8° | 180.0° |
| CAB | CAQ | CAU | CAK | 0.6° | 0.3° |
| CAQ | CAB | H15 | H16 | 120.0° | 120.0° |
| CAQ | CAB | H15 | H17 | 120.0° | 120.0° |
| CAQ | CAB | H16 | H17 | 120.0° | 120.0° |
| CAQ | CAU | CAP | CAA | 179.2° | 179.7° |
| CAQ | CAU | CAP | CAK | 179.7° | 179.7° |
| CAQ | CAU | CAK | CAI | 53.8° | 90.3° |
| CAQ | CAU | CAK | H9 | 67.3° | 149.6° |
| CAQ | CAU | CAK | H10 | 175.0° | 29.7° |
| CAU | CAQ | CAB | H15 | 179.8° | 90.5° |
| CAU | CAQ | CAB | H16 | 59.8° | 29.4° |
| CAU | CAQ | CAB | H17 | 60.2° | 149.4° |
| CAA | CAP | CAU | CAK | 1.1° | 0.0° |
| CAP | CAA | H11 | H12 | 120.0° | 120.1° |
| CAP | CAA | H11 | H13 | 120.0° | 120.0° |
| CAP | CAA | H12 | H13 | 120.0° | 120.0° |
| CAA | CAP | NAL | H14 | 0.6° | 0.1° |
| CAP | CAU | CAK | CAI | 125.8° | 90.0° |
| CAP | CAU | CAK | H9 | 113.1° | 30.0° |
| CAP | CAU | CAK | H10 | 4.7° | 150.0° |
| CAU | CAP | CAA | H11 | 90.6° | 90.0° |
| CAU | CAP | CAA | H12 | 29.4° | 149.9° |
| CAU | CAP | CAA | H13 | 149.4° | 30.0° |
| CAU | CAP | NAL | H14 | 179.6° | 179.9° |
| CAU | CAK | CAI | H9 | 121.1° | 120.0° |
| CAU | CAK | CAI | H10 | 121.1° | 120.0° |
| CAU | CAK | CAI | CAJ | 159.8° | 180.0° |
| CAU | CAK | CAI | H7 | 39.5° | 59.9° |
| CAU | CAK | CAI | H8 | 79.9° | 60.0° |
| CAU | CAK | H9 | H10 | 116.5° | 120.0° |
| CAK | CAI | CAJ | H7 | 120.3° | 120.0° |
| CAK | CAI | CAJ | H8 | 120.3° | 120.0° |
| CAK | CAI | CAJ | OAN | 66.0° | 180.0° |
| CAK | CAI | CAJ | H5 | 173.4° | 60.0° |
| CAK | CAI | CAJ | H6 | 54.7° | 60.1° |
| CAK | CAI | H7 | H8 | 119.1° | 119.9° |
| CAI | CAK | H9 | H10 | 116.5° | 120.0° |
| CAI | CAJ | OAN | H5 | 120.7° | 120.0° |
| CAI | CAJ | OAN | H6 | 120.7° | 120.0° |
| CAI | CAJ | OAN | CAT | 152.1° | 180.0° |
| CAI | CAJ | H5 | H6 | 117.9° | 120.0° |
| CAJ | CAI | H7 | H8 | 119.1° | 120.0° |
| CAJ | CAI | CAK | H9 | 79.1° | 60.0° |
| CAJ | CAI | CAK | H10 | 38.7° | 60.0° |
| CAJ | OAN | CAT | CAR | 141.5° | 180.0° |
| CAJ | OAN | CAT | CAH | 38.6° | 0.8° |
| OAN | CAJ | H5 | H6 | 118.0° | 120.0° |
| OAN | CAJ | CAI | H7 | 54.3° | 60.0° |
| OAN | CAJ | CAI | H8 | 173.7° | 60.0° |
| OAN | CAT | CAR | FAE | 1.9° | 0.5° |
| OAN | CAT | CAR | CAH | 179.8° | 179.2° |
| OAN | CAT | CAR | CAF | 179.2° | 180.0° |
| OAN | CAT | CAH | CAS | 179.1° | 179.8° |
| OAN | CAT | CAH | H2 | 0.9° | 0.2° |
| CAT | OAN | CAJ | H5 | 31.4° | 60.0° |
| CAT | OAN | CAJ | H6 | 87.3° | 60.0° |
| FAE | CAR | CAT | CAF | 177.2° | 179.5° |
| FAE | CAR | CAT | CAH | 178.3° | 179.7° |
| FAE | CAR | CAF | CAG | 179.0° | 180.0° |
| FAE | CAR | CAF | H4 | 1.0° | 0.1° |
| CAR | CAT | CAH | CAS | 0.8° | 0.5° |
| CAT | CAR | CAF | CAG | 1.6° | 0.5° |
| CAR | CAT | CAH | H2 | 179.2° | 179.5° |
| CAT | CAR | CAF | H4 | 178.4° | 179.5° |
| CAH | CAT | CAR | CAF | 1.0° | 0.8° |
| CAT | CAH | CAS | H2 | 180.0° | 180.0° |
| CAT | CAH | CAS | CAG | 1.9° | 0.0° |
| CAT | CAH | CAS | CAO | 178.3° | 179.7° |
| CAR | CAF | CAG | H4 | 180.0° | 179.9° |
| CAR | CAF | CAG | CAS | 0.4° | 0.0° |
| CAR | CAF | CAG | H3 | 179.6° | 180.0° |
| CAH | CAS | CAG | CAF | 1.3° | 0.3° |
| CAH | CAS | CAG | CAO | 179.8° | 179.7° |
| CAH | CAS | CAO | OAC | 4.1° | 0.3° |
| CAH | CAS | CAO | OAD | 174.5° | 180.0° |
| CAH | CAS | CAG | H3 | 178.7° | 179.7° |
| CAF | CAG | CAS | H3 | 180.0° | 180.0° |
| CAF | CAG | CAS | CAO | 178.9° | 180.0° |
| CAG | CAS | CAO | OAC | 176.1° | 180.0° |
| CAG | CAS | CAO | OAD | 5.3° | 0.3° |
| CAG | CAS | CAH | H2 | 178.1° | 180.0° |
| CAS | CAG | CAF | H4 | 179.6° | 180.0° |
| CAS | CAO | OAC | OAD | 178.6° | 179.7° |
| CAS | CAO | OAD | H1 | 178.6° | 179.7° |
| CAO | CAS | CAH | H2 | 1.7° | 0.3° |
| CAO | CAS | CAG | H3 | 1.1° | 0.0° |
| OAC | CAO | OAD | H1 | 0.0° | 0.1° |
| H3 | CAG | CAF | H4 | 0.4° | 0.0° |
| H5 | CAJ | CAI | H7 | 66.3° | 180.0° |
| H5 | CAJ | CAI | H8 | 53.1° | 60.0° |
| H6 | CAJ | CAI | H7 | 175.0° | 59.9° |
| H6 | CAJ | CAI | H8 | 65.6° | 180.0° |
| H7 | CAI | CAK | H9 | 160.6° | 180.0° |
| H7 | CAI | CAK | H10 | 81.6° | 60.0° |
| H8 | CAI | CAK | H9 | 41.2° | 60.0° |
| H8 | CAI | CAK | H10 | 159.0° | 180.0° |
| H11 | CAA | H12 | H13 | 120.0° | 119.9° |
| H15 | CAB | H16 | H17 | 120.0° | 120.0° |
