GUK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAM | CAL | sing | 1.53Å | 1.54Å | |
| CAN | CAL | sing | 1.53Å | 1.54Å | |
| CAL | NAK | sing | 1.46Å | 1.49Å | |
| NAK | CAD | sing | 1.39Å | 1.43Å | |
| NAG | CAE | doub | 1.33Å | 1.39Å | Aromatic |
| NAG | CAH | sing | 1.33Å | 1.44Å | Aromatic |
| CAD | CAE | sing | 1.42Å | 1.46Å | Aromatic |
| CAD | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CAE | NAF | sing | 1.37Å | 1.44Å | Aromatic |
| CAC | CAB | sing | 1.40Å | 1.42Å | Aromatic |
| CAH | CAI | doub | 1.38Å | 1.46Å | Aromatic |
| NAF | CAI | sing | 1.37Å | 1.42Å | Aromatic |
| NAF | NAA | sing | 1.40Å | 1.37Å | Aromatic |
| CAI | CAO | sing | 1.48Å | 1.48Å | |
| CAB | NAA | doub | 1.31Å | 1.35Å | Aromatic |
| CAB | CL | sing | 1.74Å | 1.82Å | |
| CAP | CAO | sing | 1.41Å | 1.47Å | Aromatic |
| CAP | CAQ | doub | 1.35Å | 1.41Å | Aromatic |
| CAO | CAT | doub | 1.38Å | 1.38Å | Aromatic |
| CAQ | CAR | sing | 1.41Å | 1.42Å | Aromatic |
| CAT | CAS | sing | 1.41Å | 1.43Å | Aromatic |
| CAR | CAS | sing | 1.47Å | 1.42Å | Aromatic |
| CAR | NAU | doub | 1.32Å | 1.42Å | Aromatic |
| CAS | CAW | doub | 1.38Å | 1.44Å | Aromatic |
| NAU | NAV | sing | 1.40Å | 1.38Å | Aromatic |
| CAW | NAV | sing | 1.34Å | 1.32Å | Aromatic |
| CAM | H1 | sing | 1.09Å | 1.10Å | |
| CAM | H2 | sing | 1.09Å | 1.10Å | |
| CAM | H3 | sing | 1.09Å | 1.10Å | |
| CAL | H4 | sing | 1.09Å | 1.10Å | |
| CAN | H5 | sing | 1.09Å | 1.10Å | |
| CAN | H6 | sing | 1.09Å | 1.10Å | |
| CAN | H7 | sing | 1.09Å | 1.10Å | |
| NAK | H8 | sing | 0.97Å | 1.00Å | |
| CAC | H9 | sing | 1.08Å | 1.08Å | |
| CAH | H10 | sing | 1.08Å | 1.08Å | |
| CAT | H11 | sing | 1.08Å | 1.08Å | |
| CAW | H12 | sing | 1.08Å | 1.08Å | |
| NAV | H13 | sing | 0.97Å | 1.00Å | |
| CAQ | H14 | sing | 1.08Å | 1.08Å | |
| CAP | H15 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAM | CAL | CAN | 105.6° | 109.5° |
| CAM | CAL | NAK | 111.2° | 109.4° |
| CAL | CAM | H1 | 109.5° | 109.5° |
| CAL | CAM | H2 | 109.5° | 109.5° |
| CAL | CAM | H3 | 109.5° | 109.5° |
| CAM | CAL | H4 | 110.4° | 109.5° |
| CAN | CAL | NAK | 108.0° | 109.5° |
| CAN | CAL | H4 | 110.4° | 109.5° |
| CAL | CAN | H5 | 109.5° | 109.5° |
| CAL | CAN | H6 | 109.4° | 109.4° |
| CAL | CAN | H7 | 109.5° | 109.5° |
| CAL | NAK | CAD | 122.3° | 120.0° |
| NAK | CAL | H4 | 111.1° | 109.5° |
| CAL | NAK | H8 | 106.2° | 120.0° |
| NAK | CAD | CAE | 123.7° | 120.6° |
| NAK | CAD | CAC | 119.2° | 120.5° |
| CAD | NAK | H8 | 106.1° | 120.0° |
| CAE | NAG | CAH | 109.8° | 109.5° |
| NAG | CAE | CAD | 137.6° | 132.4° |
| NAG | CAE | NAF | 104.6° | 108.6° |
| NAG | CAH | CAI | 109.5° | 108.2° |
| NAG | CAH | H10 | 125.2° | 125.9° |
| CAE | CAD | CAC | 117.1° | 118.9° |
| CAD | CAE | NAF | 117.8° | 119.0° |
| CAD | CAC | CAB | 120.0° | 119.9° |
| CAD | CAC | H9 | 120.0° | 120.1° |
| CAE | NAF | CAI | 113.8° | 107.0° |
| CAE | NAF | NAA | 124.1° | 120.2° |
| CAC | CAB | NAA | 125.0° | 121.0° |
| CAC | CAB | CL | 122.0° | 119.5° |
| CAB | CAC | H9 | 120.0° | 120.1° |
| CAH | CAI | NAF | 102.4° | 106.7° |
| CAH | CAI | CAO | 127.6° | 126.6° |
| CAI | CAH | H10 | 125.3° | 125.9° |
| CAI | NAF | NAA | 122.2° | 132.7° |
| NAF | CAI | CAO | 130.0° | 126.6° |
| NAF | NAA | CAB | 116.0° | 121.0° |
| CAI | CAO | CAP | 120.1° | 119.4° |
| CAI | CAO | CAT | 123.9° | 119.4° |
| NAA | CAB | CL | 113.0° | 119.5° |
| CAO | CAP | CAQ | 121.8° | 121.7° |
| CAP | CAO | CAT | 115.9° | 121.3° |
| CAO | CAP | H15 | 119.1° | 119.2° |
| CAP | CAQ | CAR | 120.8° | 119.9° |
| CAP | CAQ | H14 | 119.6° | 120.0° |
| CAQ | CAP | H15 | 119.1° | 119.1° |
| CAO | CAT | CAS | 122.9° | 119.3° |
| CAO | CAT | H11 | 118.5° | 120.3° |
| CAQ | CAR | CAS | 117.7° | 118.9° |
| CAQ | CAR | NAU | 134.5° | 134.4° |
| CAR | CAQ | H14 | 119.6° | 120.0° |
| CAT | CAS | CAR | 120.8° | 118.9° |
| CAT | CAS | CAW | 135.4° | 134.6° |
| CAS | CAT | H11 | 118.5° | 120.4° |
| CAS | CAR | NAU | 107.8° | 106.7° |
| CAR | CAS | CAW | 103.8° | 106.4° |
| CAR | NAU | NAV | 108.1° | 109.0° |
| CAS | CAW | NAV | 111.5° | 107.9° |
| CAS | CAW | H12 | 124.2° | 126.0° |
| NAU | NAV | CAW | 108.8° | 109.9° |
| NAU | NAV | H13 | 125.6° | 125.0° |
| NAV | CAW | H12 | 124.3° | 126.1° |
| CAW | NAV | H13 | 125.6° | 125.0° |
| H1 | CAM | H2 | 109.5° | 109.4° |
| H1 | CAM | H3 | 109.5° | 109.4° |
| H2 | CAM | H3 | 109.5° | 109.5° |
| H5 | CAN | H6 | 109.5° | 109.5° |
| H5 | CAN | H7 | 109.5° | 109.5° |
| H6 | CAN | H7 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAM | CAL | CAN | NAK | 119.0° | 120.0° |
| CAM | CAL | CAN | H4 | 119.3° | 120.0° |
| CAM | CAL | NAK | H4 | 123.4° | 120.0° |
| CAM | CAL | NAK | CAD | 106.9° | 85.0° |
| CAL | CAM | H1 | H2 | 120.0° | 120.0° |
| CAL | CAM | H1 | H3 | 120.0° | 120.0° |
| CAL | CAM | H2 | H3 | 120.0° | 120.0° |
| CAM | CAL | CAN | H5 | 180.0° | 60.0° |
| CAM | CAL | CAN | H6 | 60.0° | 180.0° |
| CAM | CAL | CAN | H7 | 60.0° | 60.1° |
| CAM | CAL | NAK | H8 | 14.9° | 95.0° |
| CAN | CAL | NAK | H4 | 121.2° | 120.0° |
| CAN | CAL | NAK | CAD | 137.7° | 155.0° |
| CAN | CAL | CAM | H1 | 180.0° | 60.0° |
| CAN | CAL | CAM | H2 | 60.0° | 180.0° |
| CAN | CAL | CAM | H3 | 60.0° | 59.9° |
| CAL | CAN | H5 | H6 | 120.0° | 120.0° |
| CAL | CAN | H5 | H7 | 120.0° | 120.0° |
| CAL | CAN | H6 | H7 | 120.0° | 119.9° |
| CAN | CAL | NAK | H8 | 100.6° | 25.0° |
| CAL | NAK | CAD | H8 | 121.8° | 180.0° |
| CAL | NAK | CAD | CAE | 168.2° | 180.0° |
| CAL | NAK | CAD | CAC | 12.1° | 0.3° |
| NAK | CAL | CAM | H1 | 63.1° | 180.0° |
| NAK | CAL | CAM | H2 | 176.9° | 60.0° |
| NAK | CAL | CAM | H3 | 56.9° | 60.0° |
| NAK | CAL | CAN | H5 | 61.0° | 60.0° |
| NAK | CAL | CAN | H6 | 59.0° | 60.1° |
| NAK | CAL | CAN | H7 | 179.0° | 180.0° |
| NAK | CAD | CAE | NAG | 0.2° | 0.0° |
| NAK | CAD | CAE | CAC | 179.7° | 179.7° |
| NAK | CAD | CAE | NAF | 179.9° | 179.8° |
| NAK | CAD | CAC | CAB | 179.9° | 179.9° |
| CAD | NAK | CAL | H4 | 16.5° | 35.0° |
| NAK | CAD | CAC | H9 | 0.1° | 0.1° |
| NAG | CAE | CAD | NAF | 179.9° | 179.8° |
| NAG | CAE | CAD | CAC | 179.9° | 179.7° |
| CAE | NAG | CAH | CAI | 0.1° | 0.4° |
| NAG | CAE | NAF | CAI | 0.2° | 0.2° |
| NAG | CAE | NAF | NAA | 179.9° | 179.6° |
| CAE | NAG | CAH | H10 | 179.8° | 180.0° |
| CAH | NAG | CAE | CAD | 179.9° | 180.0° |
| CAH | NAG | CAE | NAF | 0.1° | 0.1° |
| NAG | CAH | CAI | H10 | 180.0° | 179.6° |
| NAG | CAH | CAI | NAF | 0.3° | 0.5° |
| NAG | CAH | CAI | CAO | 179.6° | 179.9° |
| CAE | CAD | CAC | CAB | 0.2° | 0.2° |
| CAD | CAE | NAF | CAI | 179.7° | 179.7° |
| CAD | CAE | NAF | NAA | 0.2° | 0.5° |
| CAE | CAD | NAK | H8 | 46.4° | 0.0° |
| CAE | CAD | CAC | H9 | 179.8° | 179.8° |
| CAC | CAD | CAE | NAF | 0.2° | 0.5° |
| CAD | CAC | CAB | H9 | 180.0° | 180.0° |
| CAD | CAC | CAB | NAA | 0.3° | 0.0° |
| CAD | CAC | CAB | CL | 179.9° | 180.0° |
| CAC | CAD | NAK | H8 | 133.9° | 179.7° |
| CAE | NAF | CAI | CAH | 0.3° | 0.4° |
| CAE | NAF | CAI | NAA | 179.9° | 179.8° |
| CAE | NAF | CAI | CAO | 179.6° | 179.8° |
| CAE | NAF | NAA | CAB | 0.2° | 0.2° |
| CAC | CAB | NAA | NAF | 0.3° | 0.0° |
| CAC | CAB | NAA | CL | 179.8° | 180.0° |
| CAH | CAI | NAF | CAO | 179.3° | 179.4° |
| CAH | CAI | NAF | NAA | 179.8° | 179.4° |
| CAH | CAI | CAO | CAP | 28.3° | 174.5° |
| CAH | CAI | CAO | CAT | 151.4° | 5.7° |
| CAI | NAF | NAA | CAB | 179.7° | 180.0° |
| NAF | CAI | CAO | CAP | 152.5° | 4.7° |
| NAF | CAI | CAO | CAT | 27.8° | 175.0° |
| NAF | CAI | CAH | H10 | 179.7° | 179.9° |
| NAA | NAF | CAI | CAO | 0.5° | 0.0° |
| NAF | NAA | CAB | CL | 179.9° | 180.0° |
| CAI | CAO | CAP | CAT | 179.7° | 179.7° |
| CAI | CAO | CAP | CAQ | 179.7° | 179.8° |
| CAI | CAO | CAT | CAS | 179.6° | 180.0° |
| CAO | CAI | CAH | H10 | 0.4° | 0.5° |
| CAI | CAO | CAT | H11 | 0.4° | 0.0° |
| CAI | CAO | CAP | H15 | 0.3° | 0.0° |
| NAA | CAB | CAC | H9 | 179.7° | 180.0° |
| CL | CAB | CAC | H9 | 0.1° | 0.0° |
| CAO | CAP | CAQ | H15 | 180.0° | 179.8° |
| CAO | CAP | CAQ | CAR | 0.1° | 0.5° |
| CAP | CAO | CAT | CAS | 0.1° | 0.3° |
| CAP | CAO | CAT | H11 | 179.9° | 179.7° |
| CAO | CAP | CAQ | H14 | 179.9° | 179.8° |
| CAQ | CAP | CAO | CAT | 0.0° | 0.5° |
| CAP | CAQ | CAR | H14 | 180.0° | 179.7° |
| CAP | CAQ | CAR | CAS | 0.2° | 0.2° |
| CAP | CAQ | CAR | NAU | 179.9° | 179.8° |
| CAO | CAT | CAS | H11 | 180.0° | 180.0° |
| CAO | CAT | CAS | CAR | 0.0° | 0.0° |
| CAO | CAT | CAS | CAW | 179.9° | 180.0° |
| CAT | CAO | CAP | H15 | 180.0° | 179.7° |
| CAQ | CAR | CAS | CAT | 0.1° | 0.0° |
| CAQ | CAR | CAS | NAU | 179.9° | 180.0° |
| CAQ | CAR | CAS | CAW | 179.9° | 180.0° |
| CAQ | CAR | NAU | NAV | 179.7° | 180.0° |
| CAR | CAQ | CAP | H15 | 179.9° | 179.7° |
| CAT | CAS | CAR | CAW | 180.0° | 180.0° |
| CAT | CAS | CAR | NAU | 179.9° | 180.0° |
| CAT | CAS | CAW | NAV | 179.8° | 180.0° |
| CAT | CAS | CAW | H12 | 0.2° | 0.0° |
| CAS | CAR | NAU | NAV | 0.2° | 0.0° |
| CAR | CAS | CAW | NAV | 0.2° | 0.0° |
| CAR | CAS | CAT | H11 | 180.0° | 179.9° |
| CAR | CAS | CAW | H12 | 179.8° | 180.0° |
| CAS | CAR | CAQ | H14 | 179.8° | 180.0° |
| NAU | CAR | CAS | CAW | 0.0° | 0.0° |
| CAR | NAU | NAV | CAW | 0.4° | 0.0° |
| CAR | NAU | NAV | H13 | 179.6° | 180.0° |
| NAU | CAR | CAQ | H14 | 0.1° | 0.1° |
| CAS | CAW | NAV | NAU | 0.4° | 0.0° |
| CAS | CAW | NAV | H12 | 180.0° | 180.0° |
| CAW | CAS | CAT | H11 | 0.1° | 0.1° |
| CAS | CAW | NAV | H13 | 179.6° | 180.0° |
| NAU | NAV | CAW | H13 | 180.0° | 180.0° |
| NAU | NAV | CAW | H12 | 179.6° | 180.0° |
| H1 | CAM | H2 | H3 | 120.0° | 120.0° |
| H1 | CAM | CAL | H4 | 60.7° | 60.0° |
| H2 | CAM | CAL | H4 | 59.3° | 60.0° |
| H3 | CAM | CAL | H4 | 179.3° | 179.9° |
| H4 | CAL | CAN | H5 | 60.7° | 180.0° |
| H4 | CAL | CAN | H6 | 179.3° | 60.0° |
| H4 | CAL | CAN | H7 | 59.3° | 60.0° |
| H4 | CAL | NAK | H8 | 138.3° | 145.0° |
| H5 | CAN | H6 | H7 | 120.0° | 120.0° |
| H12 | CAW | NAV | H13 | 0.4° | 0.0° |
| H14 | CAQ | CAP | H15 | 0.1° | 0.0° |
