NZ8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CLK | CBJ | sing | 1.74Å | 1.76Å | |
FAC | CAB | sing | 1.40Å | 1.36Å | |
CBJ | CBI | doub | 1.38Å | 1.38Å | Aromatic |
CBJ | CAE | sing | 1.38Å | 1.37Å | Aromatic |
CBI | CBH | sing | 1.38Å | 1.38Å | Aromatic |
CAB | CAE | sing | 1.51Å | 1.53Å | |
CAB | FAD | sing | 1.40Å | 1.36Å | |
CAB | FAA | sing | 1.40Å | 1.39Å | |
CAE | CAF | doub | 1.38Å | 1.38Å | Aromatic |
CBH | CAG | doub | 1.39Å | 1.39Å | Aromatic |
CAF | CAG | sing | 1.39Å | 1.38Å | Aromatic |
CAG | NAH | sing | 1.40Å | 1.42Å | |
NAH | CAI | sing | 1.35Å | 1.42Å | |
CAI | OAJ | doub | 1.22Å | 1.18Å | |
CAI | NAK | sing | 1.35Å | 1.45Å | |
NAK | CAL | sing | 1.40Å | 1.44Å | |
CAL | CAM | doub | 1.39Å | 1.39Å | Aromatic |
CAL | CBA | sing | 1.39Å | 1.38Å | Aromatic |
CAM | CAN | sing | 1.38Å | 1.38Å | Aromatic |
CBA | CAZ | doub | 1.39Å | 1.41Å | Aromatic |
CAN | CAO | doub | 1.39Å | 1.42Å | Aromatic |
CAZ | CAO | sing | 1.39Å | 1.38Å | Aromatic |
CAZ | OAY | sing | 1.36Å | 1.41Å | |
CAO | NAP | sing | 1.40Å | 1.48Å | |
OAY | CAX | sing | 1.35Å | 1.42Å | |
CBC | CBD | doub | 1.38Å | 1.39Å | Aromatic |
CBC | CBB | sing | 1.39Å | 1.40Å | Aromatic |
NAW | CAX | doub | 1.32Å | 1.36Å | Aromatic |
NAW | CAV | sing | 1.32Å | 1.32Å | Aromatic |
CAX | CAS | sing | 1.40Å | 1.37Å | Aromatic |
CBD | NBE | sing | 1.32Å | 1.32Å | Aromatic |
NAP | CBB | sing | 1.39Å | 1.47Å | |
NAP | CAQ | sing | 1.33Å | 1.44Å | |
CAV | CAU | doub | 1.38Å | 1.40Å | Aromatic |
CBB | CBG | doub | 1.39Å | 1.39Å | Aromatic |
CAS | CAQ | sing | 1.47Å | 1.54Å | |
CAS | CAT | doub | 1.40Å | 1.41Å | Aromatic |
NBE | CBF | doub | 1.32Å | 1.31Å | Aromatic |
CAQ | OAR | doub | 1.22Å | 1.17Å | |
CAU | CAT | sing | 1.38Å | 1.40Å | Aromatic |
CBG | CBF | sing | 1.38Å | 1.38Å | Aromatic |
CAF | H1 | sing | 1.08Å | 1.08Å | |
CAM | H2 | sing | 1.08Å | 1.08Å | |
CAN | H3 | sing | 1.08Å | 1.08Å | |
CAT | H4 | sing | 1.08Å | 1.08Å | |
CAU | H5 | sing | 1.08Å | 1.08Å | |
CAV | H6 | sing | 1.08Å | 1.08Å | |
CBA | H7 | sing | 1.08Å | 1.08Å | |
CBC | H8 | sing | 1.08Å | 1.08Å | |
CBD | H9 | sing | 1.08Å | 1.08Å | |
CBF | H10 | sing | 1.08Å | 1.08Å | |
CBG | H11 | sing | 1.08Å | 1.08Å | |
CBH | H12 | sing | 1.08Å | 1.08Å | |
CBI | H13 | sing | 1.08Å | 1.08Å | |
NAH | H14 | sing | 0.97Å | 1.00Å | |
NAK | H15 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CLK | CBJ | CBI | 121.0° | 119.9° |
CLK | CBJ | CAE | 116.3° | 119.9° |
FAC | CAB | CAE | 106.1° | 109.5° |
FAC | CAB | FAD | 107.0° | 109.5° |
FAC | CAB | FAA | 112.5° | 109.5° |
CBI | CBJ | CAE | 122.7° | 120.1° |
CBJ | CBI | CBH | 119.1° | 120.1° |
CBJ | CBI | H13 | 120.5° | 120.0° |
CBJ | CAE | CAB | 117.8° | 120.0° |
CBJ | CAE | CAF | 118.8° | 120.1° |
CBI | CBH | CAG | 117.9° | 119.9° |
CBI | CBH | H12 | 121.0° | 120.0° |
CBH | CBI | H13 | 120.4° | 119.9° |
CAE | CAB | FAD | 108.7° | 109.5° |
CAE | CAB | FAA | 113.0° | 109.5° |
CAB | CAE | CAF | 123.4° | 120.0° |
FAD | CAB | FAA | 109.1° | 109.5° |
CAE | CAF | CAG | 118.7° | 119.9° |
CAE | CAF | H1 | 120.6° | 120.0° |
CBH | CAG | CAF | 122.7° | 119.9° |
CBH | CAG | NAH | 116.0° | 120.1° |
CAG | CBH | H12 | 121.0° | 120.0° |
CAF | CAG | NAH | 121.2° | 120.0° |
CAG | CAF | H1 | 120.6° | 120.1° |
CAG | NAH | CAI | 123.8° | 120.0° |
CAG | NAH | H14 | 118.1° | 120.1° |
NAH | CAI | OAJ | 121.0° | 120.0° |
NAH | CAI | NAK | 113.6° | 120.0° |
CAI | NAH | H14 | 118.1° | 120.0° |
OAJ | CAI | NAK | 125.4° | 120.0° |
CAI | NAK | CAL | 122.2° | 120.0° |
CAI | NAK | H15 | 118.9° | 120.0° |
NAK | CAL | CAM | 121.8° | 120.0° |
NAK | CAL | CBA | 116.3° | 120.1° |
CAL | NAK | H15 | 118.9° | 120.0° |
CAM | CAL | CBA | 121.8° | 119.9° |
CAL | CAM | CAN | 120.4° | 120.0° |
CAL | CAM | H2 | 119.8° | 120.0° |
CAL | CBA | CAZ | 117.6° | 120.2° |
CAL | CBA | H7 | 121.2° | 119.9° |
CAM | CAN | CAO | 119.0° | 120.4° |
CAN | CAM | H2 | 119.8° | 120.0° |
CAM | CAN | H3 | 120.5° | 119.7° |
CBA | CAZ | CAO | 121.6° | 119.9° |
CBA | CAZ | OAY | 117.3° | 118.7° |
CAZ | CBA | H7 | 121.2° | 119.9° |
CAN | CAO | CAZ | 119.6° | 119.7° |
CAN | CAO | NAP | 119.9° | 118.8° |
CAO | CAN | H3 | 120.5° | 119.9° |
CAO | CAZ | OAY | 121.1° | 121.4° |
CAZ | CAO | NAP | 120.4° | 121.5° |
CAZ | OAY | CAX | 110.2° | 118.4° |
CAO | NAP | CBB | 118.4° | 117.0° |
CAO | NAP | CAQ | 123.4° | 126.1° |
OAY | CAX | NAW | 118.0° | 119.6° |
OAY | CAX | CAS | 120.7° | 120.2° |
CBD | CBC | CBB | 119.4° | 119.1° |
CBC | CBD | NBE | 122.2° | 120.9° |
CBD | CBC | H8 | 120.3° | 120.5° |
CBC | CBD | H9 | 118.9° | 119.6° |
CBC | CBB | NAP | 121.6° | 120.9° |
CBC | CBB | CBG | 115.5° | 118.2° |
CBB | CBC | H8 | 120.3° | 120.4° |
CAX | NAW | CAV | 121.0° | 121.9° |
NAW | CAX | CAS | 121.3° | 120.2° |
NAW | CAV | CAU | 120.2° | 121.2° |
NAW | CAV | H6 | 119.9° | 119.4° |
CAX | CAS | CAQ | 121.0° | 121.0° |
CAX | CAS | CAT | 119.7° | 118.9° |
CBD | NBE | CBF | 120.5° | 121.9° |
NBE | CBD | H9 | 118.9° | 119.6° |
CBB | NAP | CAQ | 118.2° | 117.0° |
NAP | CBB | CBG | 122.8° | 120.8° |
NAP | CAQ | CAS | 121.6° | 124.9° |
NAP | CAQ | OAR | 121.7° | 117.5° |
CAV | CAU | CAT | 121.0° | 119.4° |
CAV | CAU | H5 | 119.5° | 120.3° |
CAU | CAV | H6 | 119.9° | 119.4° |
CBB | CBG | CBF | 121.9° | 119.1° |
CBB | CBG | H11 | 119.0° | 120.5° |
CAQ | CAS | CAT | 119.2° | 120.1° |
CAS | CAQ | OAR | 116.5° | 117.5° |
CAS | CAT | CAU | 116.7° | 118.4° |
CAS | CAT | H4 | 121.6° | 120.8° |
NBE | CBF | CBG | 120.4° | 120.9° |
NBE | CBF | H10 | 119.8° | 119.6° |
CAU | CAT | H4 | 121.6° | 120.8° |
CAT | CAU | H5 | 119.5° | 120.3° |
CBG | CBF | H10 | 119.8° | 119.6° |
CBF | CBG | H11 | 119.0° | 120.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CLK | CBJ | CBI | CAE | 179.4° | 179.4° |
CLK | CBJ | CBI | CBH | 178.5° | 179.9° |
CLK | CBJ | CAE | CAB | 0.9° | 0.3° |
CLK | CBJ | CAE | CAF | 179.8° | 180.0° |
CLK | CBJ | CBI | H13 | 1.5° | 0.2° |
FAC | CAB | CAE | CBJ | 47.1° | 59.7° |
FAC | CAB | CAE | FAD | 114.8° | 120.0° |
FAC | CAB | CAE | FAA | 123.8° | 120.0° |
FAC | CAB | FAD | FAA | 122.0° | 120.0° |
FAC | CAB | CAE | CAF | 132.3° | 120.0° |
CBJ | CBI | CBH | H13 | 180.0° | 179.8° |
CBI | CBJ | CAE | CAB | 179.8° | 179.8° |
CBI | CBJ | CAE | CAF | 0.4° | 0.6° |
CBJ | CBI | CBH | CAG | 1.8° | 0.2° |
CBJ | CBI | CBH | H12 | 178.2° | 179.7° |
CAE | CBJ | CBI | CBH | 0.9° | 0.5° |
CBJ | CAE | CAB | CAF | 179.4° | 179.7° |
CBJ | CAE | CAB | FAD | 67.7° | 179.7° |
CBJ | CAE | CAB | FAA | 170.9° | 60.3° |
CBJ | CAE | CAF | CAG | 0.7° | 0.3° |
CBJ | CAE | CAF | H1 | 179.3° | 179.7° |
CAE | CBJ | CBI | H13 | 179.1° | 179.7° |
CBI | CBH | CAG | H12 | 180.0° | 179.9° |
CBI | CBH | CAG | CAF | 1.5° | 0.1° |
CBI | CBH | CAG | NAH | 178.9° | 180.0° |
CAE | CAB | FAD | FAA | 123.7° | 120.0° |
CAB | CAE | CAF | CAG | 180.0° | 180.0° |
CAB | CAE | CAF | H1 | 0.0° | 0.1° |
FAD | CAB | CAE | CAF | 112.9° | 0.0° |
FAA | CAB | CAE | CAF | 8.5° | 120.0° |
CAE | CAF | CAG | CBH | 0.3° | 0.0° |
CAE | CAF | CAG | H1 | 180.0° | 179.9° |
CAE | CAF | CAG | NAH | 179.9° | 179.9° |
CBH | CAG | CAF | NAH | 179.6° | 180.0° |
CBH | CAG | NAH | CAI | 154.3° | 35.3° |
CBH | CAG | CAF | H1 | 179.7° | 179.9° |
CAG | CBH | CBI | H13 | 178.3° | 180.0° |
CBH | CAG | NAH | H14 | 25.7° | 144.7° |
CAF | CAG | NAH | CAI | 25.3° | 144.8° |
CAF | CAG | CBH | H12 | 178.5° | 180.0° |
CAF | CAG | NAH | H14 | 154.7° | 35.2° |
CAG | NAH | CAI | H14 | 180.0° | 180.0° |
CAG | NAH | CAI | OAJ | 1.6° | 4.1° |
CAG | NAH | CAI | NAK | 179.1° | 175.9° |
NAH | CAG | CAF | H1 | 0.1° | 0.0° |
NAH | CAG | CBH | H12 | 1.1° | 0.1° |
NAH | CAI | OAJ | NAK | 179.2° | 180.0° |
NAH | CAI | NAK | CAL | 177.9° | 175.9° |
NAH | CAI | NAK | H15 | 2.1° | 4.0° |
OAJ | CAI | NAK | CAL | 2.8° | 4.0° |
OAJ | CAI | NAH | H14 | 178.4° | 175.9° |
OAJ | CAI | NAK | H15 | 177.2° | 176.0° |
CAI | NAK | CAL | H15 | 180.0° | 180.0° |
CAI | NAK | CAL | CAM | 21.0° | 144.7° |
CAI | NAK | CAL | CBA | 155.1° | 35.5° |
NAK | CAI | NAH | H14 | 0.9° | 4.1° |
NAK | CAL | CAM | CBA | 176.0° | 179.8° |
NAK | CAL | CAM | CAN | 177.0° | 179.7° |
NAK | CAL | CBA | CAZ | 177.9° | 179.6° |
NAK | CAL | CAM | H2 | 3.0° | 0.4° |
NAK | CAL | CBA | H7 | 2.1° | 0.5° |
CAL | CAM | CAN | H2 | 180.0° | 180.0° |
CAM | CAL | CBA | CAZ | 1.7° | 0.2° |
CAL | CAM | CAN | CAO | 0.6° | 0.4° |
CAL | CAM | CAN | H3 | 179.4° | 179.6° |
CAM | CAL | CBA | H7 | 178.3° | 179.7° |
CAM | CAL | NAK | H15 | 159.0° | 35.3° |
CBA | CAL | CAM | CAN | 1.0° | 0.5° |
CAL | CBA | CAZ | H7 | 180.0° | 180.0° |
CAL | CBA | CAZ | CAO | 0.8° | 1.1° |
CAL | CBA | CAZ | OAY | 179.2° | 177.8° |
CBA | CAL | CAM | H2 | 179.0° | 179.4° |
CBA | CAL | NAK | H15 | 24.9° | 144.5° |
CAM | CAN | CAO | H3 | 180.0° | 180.0° |
CAM | CAN | CAO | CAZ | 1.5° | 0.5° |
CAM | CAN | CAO | NAP | 179.2° | 178.1° |
CBA | CAZ | CAO | CAN | 0.7° | 1.3° |
CBA | CAZ | CAO | OAY | 180.0° | 178.9° |
CBA | CAZ | CAO | NAP | 178.5° | 177.4° |
CBA | CAZ | OAY | CAX | 105.7° | 115.3° |
CAN | CAO | CAZ | NAP | 177.8° | 178.6° |
CAN | CAO | CAZ | OAY | 179.2° | 177.6° |
CAN | CAO | NAP | CBB | 41.3° | 38.3° |
CAN | CAO | NAP | CAQ | 135.1° | 141.6° |
CAO | CAN | CAM | H2 | 179.4° | 179.6° |
CAO | CAZ | OAY | CAX | 74.2° | 63.5° |
CAZ | CAO | NAP | CBB | 141.0° | 140.3° |
CAZ | CAO | NAP | CAQ | 42.6° | 39.8° |
CAZ | CAO | CAN | H3 | 178.6° | 179.5° |
CAO | CAZ | CBA | H7 | 179.1° | 178.8° |
OAY | CAZ | CAO | NAP | 1.5° | 3.8° |
CAZ | OAY | CAX | NAW | 108.4° | 116.0° |
CAZ | OAY | CAX | CAS | 69.9° | 61.8° |
OAY | CAZ | CBA | H7 | 0.8° | 2.3° |
CAO | NAP | CBB | CBC | 34.5° | 123.3° |
CAO | NAP | CBB | CAQ | 176.6° | 179.9° |
CAO | NAP | CBB | CBG | 143.8° | 57.0° |
CAO | NAP | CAQ | CAS | 4.0° | 1.3° |
CAO | NAP | CAQ | OAR | 180.0° | 178.7° |
NAP | CAO | CAN | H3 | 0.8° | 1.8° |
OAY | CAX | NAW | CAS | 178.3° | 177.8° |
OAY | CAX | NAW | CAV | 179.3° | 176.4° |
OAY | CAX | CAS | CAQ | 2.9° | 4.3° |
OAY | CAX | CAS | CAT | 180.0° | 175.9° |
CBD | CBC | CBB | H8 | 180.0° | 180.0° |
CBC | CBD | NBE | H9 | 180.0° | 179.9° |
CBD | CBC | CBB | NAP | 178.5° | 179.7° |
CBD | CBC | CBB | CBG | 0.1° | 0.0° |
CBC | CBD | NBE | CBF | 0.5° | 0.1° |
CBB | CBC | CBD | NBE | 0.4° | 0.1° |
CBC | CBB | NAP | CBG | 178.3° | 179.7° |
CBC | CBB | NAP | CAQ | 148.9° | 56.6° |
CBC | CBB | CBG | CBF | 0.1° | 0.0° |
CBB | CBC | CBD | H9 | 179.6° | 180.0° |
CBC | CBB | CBG | H11 | 179.9° | 180.0° |
CAX | NAW | CAV | CAU | 0.3° | 0.1° |
NAW | CAX | CAS | CAQ | 178.9° | 177.9° |
NAW | CAX | CAS | CAT | 1.7° | 1.8° |
CAX | NAW | CAV | H6 | 179.7° | 179.8° |
CAV | NAW | CAX | CAS | 1.0° | 1.4° |
NAW | CAV | CAU | H6 | 180.0° | 179.9° |
NAW | CAV | CAU | CAT | 0.9° | 0.7° |
NAW | CAV | CAU | H5 | 179.1° | 179.3° |
CAX | CAS | CAQ | NAP | 39.7° | 38.6° |
CAX | CAS | CAQ | CAT | 177.1° | 179.7° |
CAX | CAS | CAQ | OAR | 136.4° | 141.4° |
CAX | CAS | CAT | CAU | 1.1° | 1.0° |
CAX | CAS | CAT | H4 | 178.9° | 179.0° |
CBD | NBE | CBF | CBG | 0.2° | 0.1° |
NBE | CBD | CBC | H8 | 179.6° | 179.9° |
CBD | NBE | CBF | H10 | 179.7° | 179.9° |
CBB | NAP | CAQ | CAS | 179.6° | 178.8° |
CBB | NAP | CAQ | OAR | 3.6° | 1.2° |
NAP | CBB | CBG | CBF | 178.3° | 179.7° |
NAP | CBB | CBC | H8 | 1.4° | 0.3° |
NAP | CBB | CBG | H11 | 1.7° | 0.3° |
CAQ | NAP | CBB | CBG | 32.8° | 123.1° |
NAP | CAQ | CAS | OAR | 176.2° | 180.0° |
NAP | CAQ | CAS | CAT | 143.1° | 141.6° |
CAV | CAU | CAT | CAS | 0.2° | 0.2° |
CAV | CAU | CAT | H5 | 180.0° | 180.0° |
CAV | CAU | CAT | H4 | 179.8° | 179.8° |
CBB | CBG | CBF | NBE | 0.0° | 0.0° |
CBB | CBG | CBF | H11 | 180.0° | 180.0° |
CBG | CBB | CBC | H8 | 179.9° | 180.0° |
CBB | CBG | CBF | H10 | 180.0° | 180.0° |
CAQ | CAS | CAT | CAU | 178.3° | 178.7° |
CAQ | CAS | CAT | H4 | 1.7° | 1.3° |
CAT | CAS | CAQ | OAR | 40.7° | 38.3° |
CAS | CAT | CAU | H4 | 180.0° | 180.0° |
CAS | CAT | CAU | H5 | 179.8° | 179.8° |
NBE | CBF | CBG | H10 | 180.0° | 180.0° |
CBF | NBE | CBD | H9 | 179.6° | 179.9° |
NBE | CBF | CBG | H11 | 179.9° | 180.0° |
CAT | CAU | CAV | H6 | 179.1° | 179.4° |
H2 | CAM | CAN | H3 | 0.6° | 0.4° |
H4 | CAT | CAU | H5 | 0.2° | 0.2° |
H5 | CAU | CAV | H6 | 0.9° | 0.6° |
H8 | CBC | CBD | H9 | 0.4° | 0.0° |
H10 | CBF | CBG | H11 | 0.0° | 0.0° |
H12 | CBH | CBI | H13 | 1.8° | 0.1° |