G1V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAB | doub | 1.35Å | 1.34Å | Aromatic |
| CAA | NAE | sing | 1.37Å | 1.34Å | Aromatic |
| CAB | CAC | sing | 1.42Å | 1.31Å | Aromatic |
| CAB | NAI | sing | 1.40Å | 1.33Å | |
| CAC | CAF | sing | 1.48Å | 1.31Å | |
| CAC | NAD | doub | 1.32Å | 1.32Å | Aromatic |
| CAF | NAH | sing | 1.35Å | 1.34Å | |
| CAF | OAG | doub | 1.22Å | 1.23Å | |
| CAJ | CAL | sing | 1.48Å | 1.39Å | |
| CAJ | NAI | sing | 1.35Å | 1.35Å | |
| CAJ | OAK | doub | 1.22Å | 1.23Å | |
| CAL | CAM | doub | 1.40Å | 1.38Å | Aromatic |
| CAL | CAQ | sing | 1.40Å | 1.41Å | Aromatic |
| CAM | CAN | sing | 1.38Å | 1.39Å | Aromatic |
| CAM | CLAR | sing | 1.74Å | 1.69Å | |
| CAN | CAO | doub | 1.38Å | 1.38Å | Aromatic |
| CAO | CAP | sing | 1.38Å | 1.38Å | Aromatic |
| CAP | CAQ | doub | 1.38Å | 1.39Å | Aromatic |
| CAQ | CLAS | sing | 1.74Å | 1.71Å | |
| CAT | CAV | sing | 1.47Å | 1.42Å | |
| CAT | NAE | sing | 1.35Å | 1.33Å | |
| CAT | OAU | doub | 1.22Å | 1.23Å | |
| CAV | CAW | doub | 1.40Å | 1.43Å | Aromatic |
| CAV | CBA | sing | 1.40Å | 1.41Å | Aromatic |
| CAW | CAX | sing | 1.38Å | 1.39Å | Aromatic |
| CAW | CLBC | sing | 1.74Å | 1.74Å | |
| CAX | CAY | doub | 1.38Å | 1.37Å | Aromatic |
| CAY | CAZ | sing | 1.38Å | 1.37Å | Aromatic |
| CAZ | CBA | doub | 1.38Å | 1.38Å | Aromatic |
| CBA | CLBB | sing | 1.74Å | 1.70Å | |
| CBD | CBE | sing | 1.53Å | 1.64Å | |
| CBD | CBF | sing | 1.53Å | 1.65Å | |
| CBD | NAH | sing | 1.47Å | 1.47Å | |
| CBE | CBF | sing | 1.54Å | 1.36Å | |
| CBE | CBG | sing | 1.54Å | 1.57Å | |
| CBF | CBI | sing | 1.54Å | 1.56Å | |
| CBG | NBH | sing | 1.49Å | 1.44Å | |
| CBI | NBH | sing | 1.49Å | 1.44Å | |
| NAD | NAE | sing | 1.40Å | 1.33Å | Aromatic |
| CAA | H1 | sing | 1.08Å | 1.08Å | |
| CAN | H4 | sing | 1.08Å | 1.08Å | |
| CAO | H5 | sing | 1.08Å | 1.08Å | |
| CAP | H6 | sing | 1.08Å | 1.08Å | |
| CAX | H7 | sing | 1.08Å | 1.08Å | |
| CAY | H8 | sing | 1.08Å | 1.08Å | |
| CAZ | H9 | sing | 1.08Å | 1.08Å | |
| CBD | H10 | sing | 1.09Å | 1.10Å | |
| CBE | H11 | sing | 1.09Å | 1.10Å | |
| CBF | H12 | sing | 1.09Å | 1.10Å | |
| CBG | H13 | sing | 1.09Å | 1.10Å | |
| CBG | H14 | sing | 1.09Å | 1.10Å | |
| CBI | H15 | sing | 1.09Å | 1.10Å | |
| CBI | H16 | sing | 1.09Å | 1.10Å | |
| NAH | H18 | sing | 0.97Å | 1.00Å | |
| NBH | H19 | sing | 1.01Å | 1.00Å | |
| NAI | H2 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAB | CAA | NAE | 109.4° | 107.8° |
| CAA | CAB | CAC | 105.0° | 107.7° |
| CAA | CAB | NAI | 129.5° | 126.1° |
| CAB | CAA | H1 | 125.3° | 126.1° |
| CAA | NAE | CAT | 117.7° | 125.9° |
| CAA | NAE | NAD | 106.7° | 108.1° |
| NAE | CAA | H1 | 125.3° | 126.1° |
| CAC | CAB | NAI | 124.7° | 126.1° |
| CAB | CAC | CAF | 122.5° | 125.9° |
| CAB | CAC | NAD | 110.9° | 108.1° |
| CAB | NAI | CAJ | 127.8° | 120.0° |
| CAB | NAI | H2 | 116.1° | 120.0° |
| CAF | CAC | NAD | 124.8° | 126.0° |
| CAC | CAF | NAH | 115.8° | 120.0° |
| CAC | CAF | OAG | 119.5° | 120.0° |
| CAC | NAD | NAE | 106.5° | 108.3° |
| NAH | CAF | OAG | 124.6° | 120.0° |
| CAF | NAH | CBD | 122.6° | 120.0° |
| CAF | NAH | H18 | 118.7° | 120.0° |
| CAL | CAJ | NAI | 112.7° | 120.0° |
| CAL | CAJ | OAK | 120.0° | 120.0° |
| CAJ | CAL | CAM | 122.5° | 120.1° |
| CAJ | CAL | CAQ | 117.5° | 120.2° |
| NAI | CAJ | OAK | 125.3° | 120.0° |
| CAJ | NAI | H2 | 116.1° | 120.0° |
| CAM | CAL | CAQ | 115.6° | 119.7° |
| CAL | CAM | CAN | 122.0° | 119.8° |
| CAL | CAM | CLAR | 118.3° | 120.1° |
| CAL | CAQ | CAP | 120.8° | 119.8° |
| CAL | CAQ | CLAS | 123.1° | 120.1° |
| CAN | CAM | CLAR | 117.7° | 120.1° |
| CAM | CAN | CAO | 120.0° | 120.2° |
| CAM | CAN | H4 | 120.0° | 119.9° |
| CAN | CAO | CAP | 118.3° | 120.3° |
| CAO | CAN | H4 | 120.0° | 119.9° |
| CAN | CAO | H5 | 120.9° | 119.9° |
| CAO | CAP | CAQ | 120.8° | 120.2° |
| CAP | CAO | H5 | 120.8° | 119.8° |
| CAO | CAP | H6 | 119.6° | 119.9° |
| CAP | CAQ | CLAS | 115.8° | 120.1° |
| CAQ | CAP | H6 | 119.6° | 119.9° |
| CAV | CAT | NAE | 126.7° | 120.0° |
| CAV | CAT | OAU | 117.6° | 120.0° |
| CAT | CAV | CAW | 125.6° | 120.2° |
| CAT | CAV | CBA | 119.2° | 120.2° |
| NAE | CAT | OAU | 113.8° | 120.0° |
| CAT | NAE | NAD | 133.8° | 126.0° |
| CAW | CAV | CBA | 112.9° | 119.6° |
| CAV | CAW | CAX | 121.6° | 119.8° |
| CAV | CAW | CLBC | 129.0° | 120.1° |
| CAV | CBA | CAZ | 122.5° | 119.8° |
| CAV | CBA | CLBB | 125.7° | 120.1° |
| CAX | CAW | CLBC | 109.2° | 120.1° |
| CAW | CAX | CAY | 122.9° | 120.2° |
| CAW | CAX | H7 | 118.5° | 119.9° |
| CAX | CAY | CAZ | 116.1° | 120.3° |
| CAY | CAX | H7 | 118.5° | 119.9° |
| CAX | CAY | H8 | 121.9° | 119.8° |
| CAY | CAZ | CBA | 122.7° | 120.2° |
| CAZ | CAY | H8 | 122.0° | 119.8° |
| CAY | CAZ | H9 | 118.7° | 119.9° |
| CAZ | CBA | CLBB | 110.6° | 120.1° |
| CBA | CAZ | H9 | 118.6° | 119.9° |
| CBE | CBD | CBF | 48.7° | 60.6° |
| CBE | CBD | NAH | 119.7° | 117.4° |
| CBD | CBE | CBF | 65.8° | 59.7° |
| CBD | CBE | CBG | 129.2° | 118.1° |
| CBE | CBD | H10 | 115.7° | 117.5° |
| CBD | CBE | H11 | 111.2° | 119.6° |
| CBF | CBD | NAH | 119.1° | 117.4° |
| CBD | CBF | CBE | 65.5° | 59.7° |
| CBD | CBF | CBI | 129.6° | 118.2° |
| CBF | CBD | H10 | 115.6° | 117.4° |
| CBD | CBF | H12 | 110.9° | 119.6° |
| NAH | CBD | H10 | 119.0° | 115.5° |
| CBD | NAH | H18 | 118.7° | 120.0° |
| CBF | CBE | CBG | 114.6° | 105.1° |
| CBE | CBF | CBI | 115.3° | 105.1° |
| CBF | CBE | H11 | 116.0° | 121.8° |
| CBE | CBF | H12 | 115.7° | 121.8° |
| CBE | CBG | NBH | 75.8° | 104.6° |
| CBG | CBE | H11 | 112.3° | 118.1° |
| CBE | CBG | H13 | 117.1° | 110.4° |
| CBE | CBG | H14 | 117.1° | 110.4° |
| CBF | CBI | NBH | 75.6° | 104.6° |
| CBI | CBF | H12 | 112.1° | 118.1° |
| CBF | CBI | H15 | 117.2° | 110.4° |
| CBF | CBI | H16 | 117.1° | 110.5° |
| CBG | NBH | CBI | 136.5° | 104.2° |
| NBH | CBG | H13 | 117.1° | 110.4° |
| NBH | CBG | H14 | 117.1° | 110.4° |
| CBG | NBH | H19 | 102.3° | 111.0° |
| NBH | CBI | H15 | 117.1° | 110.4° |
| NBH | CBI | H16 | 117.1° | 110.4° |
| CBI | NBH | H19 | 102.4° | 111.0° |
| H13 | CBG | H14 | 109.5° | 110.4° |
| H15 | CBI | H16 | 109.5° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAB | CAA | NAE | H1 | 180.0° | 179.7° |
| CAA | CAB | CAC | NAI | 170.2° | 179.9° |
| CAA | CAB | CAC | CAF | 174.5° | 180.0° |
| CAA | CAB | CAC | NAD | 9.3° | 0.0° |
| CAA | CAB | NAI | CAJ | 13.4° | 0.0° |
| CAB | CAA | NAE | CAT | 172.1° | 180.0° |
| CAB | CAA | NAE | NAD | 5.1° | 0.1° |
| CAA | CAB | NAI | H2 | 166.5° | 180.0° |
| NAE | CAA | CAB | CAC | 2.4° | 0.0° |
| NAE | CAA | CAB | NAI | 172.0° | 180.0° |
| CAA | NAE | NAD | CAC | 10.5° | 0.0° |
| CAA | NAE | CAT | CAV | 179.9° | 174.9° |
| CAA | NAE | CAT | NAD | 162.6° | 179.9° |
| CAA | NAE | CAT | OAU | 16.3° | 5.0° |
| CAB | CAC | CAF | NAD | 163.1° | 180.0° |
| CAB | CAC | CAF | NAH | 176.9° | 175.0° |
| CAB | CAC | CAF | OAG | 0.2° | 5.1° |
| CAC | CAB | NAI | CAJ | 178.9° | 180.0° |
| CAB | CAC | NAD | NAE | 12.6° | 0.0° |
| CAC | CAB | CAA | H1 | 177.5° | 179.7° |
| CAC | CAB | NAI | H2 | 1.1° | 0.1° |
| NAI | CAB | CAC | CAF | 15.3° | 0.0° |
| NAI | CAB | CAC | NAD | 179.5° | 180.0° |
| CAB | NAI | CAJ | CAL | 179.9° | 179.9° |
| CAB | NAI | CAJ | H2 | 180.0° | 180.0° |
| CAB | NAI | CAJ | OAK | 16.3° | 0.0° |
| NAI | CAB | CAA | H1 | 8.0° | 0.3° |
| CAC | CAF | NAH | OAG | 176.6° | 180.0° |
| CAC | CAF | NAH | CBD | 180.0° | 175.0° |
| CAF | CAC | NAD | NAE | 177.4° | 180.0° |
| CAC | CAF | NAH | H18 | 0.0° | 5.0° |
| NAD | CAC | CAF | NAH | 13.8° | 5.0° |
| NAD | CAC | CAF | OAG | 162.9° | 175.0° |
| CAC | NAD | NAE | CAT | 174.5° | 180.0° |
| CAF | NAH | CBD | CBE | 118.9° | 155.0° |
| CAF | NAH | CBD | CBF | 62.4° | 135.7° |
| CAF | NAH | CBD | H18 | 180.0° | 180.0° |
| CAF | NAH | CBD | H10 | 88.5° | 9.6° |
| OAG | CAF | NAH | CBD | 3.4° | 5.1° |
| OAG | CAF | NAH | H18 | 176.6° | 174.9° |
| CAL | CAJ | NAI | OAK | 163.6° | 179.9° |
| CAJ | CAL | CAM | CAQ | 155.9° | 179.7° |
| CAJ | CAL | CAM | CAN | 174.9° | 180.0° |
| CAJ | CAL | CAM | CLAR | 21.5° | 0.1° |
| CAJ | CAL | CAQ | CAP | 172.2° | 179.7° |
| CAJ | CAL | CAQ | CLAS | 13.5° | 0.0° |
| CAL | CAJ | NAI | H2 | 0.0° | 0.0° |
| NAI | CAJ | CAL | CAM | 25.9° | 90.0° |
| NAI | CAJ | CAL | CAQ | 129.6° | 89.7° |
| OAK | CAJ | CAL | CAM | 138.7° | 90.1° |
| OAK | CAJ | CAL | CAQ | 65.8° | 90.2° |
| OAK | CAJ | NAI | H2 | 163.6° | 180.0° |
| CAL | CAM | CAN | CLAR | 163.7° | 179.9° |
| CAL | CAM | CAN | CAO | 13.7° | 0.0° |
| CAM | CAL | CAQ | CAP | 15.0° | 0.6° |
| CAM | CAL | CAQ | CLAS | 170.7° | 179.7° |
| CAL | CAM | CAN | H4 | 166.4° | 179.9° |
| CAQ | CAL | CAM | CAN | 19.0° | 0.3° |
| CAQ | CAL | CAM | CLAR | 177.4° | 179.8° |
| CAL | CAQ | CAP | CAO | 5.9° | 0.5° |
| CAL | CAQ | CAP | CLAS | 174.7° | 179.7° |
| CAL | CAQ | CAP | H6 | 174.1° | 179.7° |
| CAM | CAN | CAO | H4 | 180.0° | 179.9° |
| CAM | CAN | CAO | CAP | 3.4° | 0.0° |
| CAM | CAN | CAO | H5 | 176.6° | 180.0° |
| CLAR | CAM | CAN | CAO | 177.4° | 179.9° |
| CLAR | CAM | CAN | H4 | 2.7° | 0.0° |
| CAN | CAO | CAP | H5 | 180.0° | 179.9° |
| CAN | CAO | CAP | CAQ | 0.3° | 0.2° |
| CAN | CAO | CAP | H6 | 179.7° | 180.0° |
| CAO | CAP | CAQ | H6 | 180.0° | 179.8° |
| CAO | CAP | CAQ | CLAS | 179.4° | 179.8° |
| CAP | CAO | CAN | H4 | 176.7° | 180.0° |
| CAQ | CAP | CAO | H5 | 179.8° | 179.7° |
| CLAS | CAQ | CAP | H6 | 0.6° | 0.0° |
| CAV | CAT | NAE | OAU | 163.6° | 180.0° |
| CAT | CAV | CAW | CBA | 162.7° | 179.7° |
| CAT | CAV | CAW | CAX | 173.2° | 180.0° |
| CAT | CAV | CAW | CLBC | 12.0° | 0.0° |
| CAT | CAV | CBA | CAZ | 177.3° | 179.7° |
| CAT | CAV | CBA | CLBB | 16.8° | 0.0° |
| CAV | CAT | NAE | NAD | 17.5° | 5.1° |
| NAE | CAT | CAV | CAW | 38.5° | 85.1° |
| NAE | CAT | CAV | CBA | 159.8° | 94.7° |
| CAT | NAE | CAA | H1 | 7.9° | 0.2° |
| OAU | CAT | CAV | CAW | 124.6° | 94.9° |
| OAU | CAT | CAV | CBA | 37.1° | 85.4° |
| OAU | CAT | NAE | NAD | 178.9° | 174.9° |
| CAV | CAW | CAX | CLBC | 175.8° | 180.0° |
| CAV | CAW | CAX | CAY | 4.5° | 0.0° |
| CAW | CAV | CBA | CAZ | 13.4° | 0.5° |
| CAW | CAV | CBA | CLBB | 179.3° | 179.7° |
| CAV | CAW | CAX | H7 | 175.5° | 180.0° |
| CBA | CAV | CAW | CAX | 10.5° | 0.3° |
| CBA | CAV | CAW | CLBC | 174.7° | 179.8° |
| CAV | CBA | CAZ | CAY | 10.4° | 0.5° |
| CAV | CBA | CAZ | CLBB | 167.8° | 179.7° |
| CAV | CBA | CAZ | H9 | 169.6° | 179.7° |
| CAW | CAX | CAY | H7 | 180.0° | 180.0° |
| CAW | CAX | CAY | CAZ | 0.2° | 0.0° |
| CAW | CAX | CAY | H8 | 179.8° | 180.0° |
| CLBC | CAW | CAX | CAY | 179.7° | 180.0° |
| CLBC | CAW | CAX | H7 | 0.2° | 0.0° |
| CAX | CAY | CAZ | H8 | 180.0° | 180.0° |
| CAX | CAY | CAZ | CBA | 3.1° | 0.2° |
| CAX | CAY | CAZ | H9 | 177.0° | 180.0° |
| CAY | CAZ | CBA | H9 | 180.0° | 179.8° |
| CAY | CAZ | CBA | CLBB | 178.2° | 179.7° |
| CAZ | CAY | CAX | H7 | 179.8° | 180.0° |
| CBA | CAZ | CAY | H8 | 177.0° | 179.8° |
| CLBB | CBA | CAZ | H9 | 1.8° | 0.0° |
| CBE | CBD | CBF | NAH | 105.5° | 107.7° |
| CBE | CBD | CBF | H10 | 102.6° | 107.7° |
| CBE | CBD | NAH | H10 | 152.6° | 145.4° |
| CBD | CBE | CBF | CBG | 123.8° | 114.1° |
| CBD | CBE | CBF | H11 | 102.8° | 108.1° |
| CBD | CBE | CBG | H11 | 147.0° | 157.0° |
| CBE | CBD | CBF | CBI | 103.5° | 91.6° |
| CBD | CBE | CBG | NBH | 57.9° | 87.2° |
| CBE | CBD | CBF | H12 | 109.6° | 111.7° |
| CBD | CBE | CBG | H13 | 171.4° | 154.0° |
| CBD | CBE | CBG | H14 | 55.6° | 31.6° |
| CBE | CBD | NAH | H18 | 61.1° | 25.0° |
| CBF | CBD | NAH | H10 | 150.9° | 145.3° |
| CBD | CBF | CBI | H12 | 146.6° | 157.0° |
| CBD | CBF | CBI | NBH | 57.9° | 87.2° |
| CBD | CBF | CBI | H15 | 55.5° | 31.6° |
| CBD | CBF | CBI | H16 | 171.3° | 154.0° |
| CBF | CBD | NAH | H18 | 117.6° | 44.3° |
| NAH | CBD | CBE | CBG | 153.1° | 160.7° |
| NAH | CBD | CBF | CBI | 151.0° | 160.7° |
| NAH | CBD | CBE | H11 | 5.8° | 4.1° |
| NAH | CBD | CBF | H12 | 4.1° | 4.0° |
| CBF | CBE | CBG | H11 | 135.1° | 139.7° |
| CBE | CBF | CBI | H12 | 135.2° | 139.6° |
| CBF | CBE | CBG | NBH | 20.1° | 23.8° |
| CBE | CBF | CBI | NBH | 20.3° | 23.8° |
| CBF | CBE | CBG | H13 | 93.4° | 142.6° |
| CBF | CBE | CBG | H14 | 133.6° | 94.9° |
| CBE | CBF | CBI | H15 | 133.7° | 94.9° |
| CBE | CBF | CBI | H16 | 93.1° | 142.6° |
| CBG | CBE | CBF | CBI | 0.1° | 0.0° |
| CBE | CBG | NBH | H13 | 113.5° | 118.8° |
| CBE | CBG | NBH | H14 | 113.5° | 118.8° |
| CBE | CBG | NBH | CBI | 57.7° | 39.5° |
| CBG | CBE | CBD | H10 | 0.4° | 16.0° |
| CBG | CBE | CBF | H12 | 133.7° | 137.8° |
| CBE | CBG | H13 | H14 | 136.4° | 122.4° |
| CBE | CBG | NBH | H19 | 179.0° | 80.1° |
| CBF | CBI | NBH | CBG | 57.6° | 39.4° |
| CBF | CBI | NBH | H15 | 113.4° | 118.8° |
| CBF | CBI | NBH | H16 | 113.4° | 118.9° |
| CBI | CBF | CBD | H10 | 0.9° | 16.1° |
| CBI | CBF | CBE | H11 | 133.2° | 137.8° |
| CBF | CBI | H15 | H16 | 136.5° | 122.5° |
| CBF | CBI | NBH | H19 | 179.1° | 80.1° |
| CBG | NBH | CBI | H19 | 123.3° | 119.6° |
| NBH | CBG | CBE | H11 | 155.1° | 115.8° |
| NBH | CBG | H13 | H14 | 136.4° | 122.4° |
| CBG | NBH | CBI | H15 | 171.1° | 79.3° |
| CBG | NBH | CBI | H16 | 55.8° | 158.3° |
| NBH | CBI | CBF | H12 | 155.5° | 115.8° |
| CBI | NBH | CBG | H13 | 55.8° | 158.3° |
| CBI | NBH | CBG | H14 | 171.1° | 79.3° |
| NBH | CBI | H15 | H16 | 136.5° | 122.4° |
| NAD | NAE | CAA | H1 | 174.9° | 179.7° |
| H4 | CAN | CAO | H5 | 3.4° | 0.1° |
| H5 | CAO | CAP | H6 | 0.2° | 0.1° |
| H7 | CAX | CAY | H8 | 0.2° | 0.0° |
| H8 | CAY | CAZ | H9 | 3.0° | 0.0° |
| H10 | CBD | CBE | H11 | 147.6° | 140.6° |
| H10 | CBD | CBF | H12 | 147.8° | 140.6° |
| H10 | CBD | NAH | H18 | 91.5° | 170.4° |
| H11 | CBE | CBF | H12 | 0.3° | 0.0° |
| H11 | CBE | CBG | H13 | 41.7° | 3.0° |
| H11 | CBE | CBG | H14 | 91.4° | 125.4° |
| H12 | CBF | CBI | H15 | 91.1° | 125.4° |
| H12 | CBF | CBI | H16 | 42.1° | 3.0° |
| H13 | CBG | NBH | H19 | 67.5° | 38.7° |
| H14 | CBG | NBH | H19 | 65.6° | 161.1° |
| H15 | CBI | NBH | H19 | 65.6° | 161.1° |
| H16 | CBI | NBH | H19 | 67.5° | 38.7° |
