4CA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1A | C2A | sing | 1.32Å | 1.37Å | Aromatic |
| N1A | C6A | doub | 1.33Å | 1.36Å | Aromatic |
| C2A | N3A | doub | 1.32Å | 1.31Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.08Å | |
| N3A | C4A | sing | 1.33Å | 1.34Å | Aromatic |
| C4A | C5A | doub | 1.40Å | 1.37Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.37Å | Aromatic |
| C5A | C6A | sing | 1.41Å | 1.42Å | Aromatic |
| C5A | N7A | sing | 1.36Å | 1.38Å | Aromatic |
| C6A | N6A | sing | 1.38Å | 1.32Å | |
| N6A | H61A | sing | 0.97Å | 1.00Å | |
| N6A | H62A | sing | 0.97Å | 1.00Å | |
| N7A | C8A | doub | 1.30Å | 1.34Å | Aromatic |
| C8A | N9A | sing | 1.36Å | 1.36Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.08Å | |
| N9A | C1D | sing | 1.46Å | 1.43Å | |
| C1D | C2D | sing | 1.55Å | 1.51Å | |
| C1D | O4D | sing | 1.44Å | 1.38Å | |
| C1D | H1D | sing | 1.09Å | 1.10Å | |
| C2D | O2D | sing | 1.43Å | 1.41Å | |
| C2D | C3D | sing | 1.55Å | 1.52Å | |
| C2D | H2D | sing | 1.09Å | 1.10Å | |
| O2D | HO2A | sing | 0.97Å | 0.95Å | |
| C3D | O3D | sing | 1.43Å | 1.42Å | |
| C3D | C4D | sing | 1.54Å | 1.52Å | |
| C3D | H3D | sing | 1.09Å | 1.10Å | |
| O3D | P3D | sing | 1.61Å | 1.65Å | |
| P3D | O7A | doub | 1.48Å | 1.53Å | |
| P3D | O8A | sing | 1.61Å | 1.49Å | |
| P3D | O9A | sing | 1.61Å | 1.51Å | |
| O8A | HOA8 | sing | 0.97Å | 0.95Å | |
| O9A | HOA9 | sing | 0.97Å | 0.95Å | |
| C4D | O4D | sing | 1.44Å | 1.44Å | |
| C4D | C5D | sing | 1.53Å | 1.51Å | |
| C4D | H4D | sing | 1.09Å | 1.10Å | |
| C5D | O5D | sing | 1.43Å | 1.45Å | |
| C5D | H51A | sing | 1.09Å | 1.10Å | |
| C5D | H52A | sing | 1.09Å | 1.10Å | |
| O5D | P1A | sing | 1.61Å | 1.60Å | |
| P1A | O1A | doub | 1.48Å | 1.51Å | |
| P1A | O2A | sing | 1.61Å | 1.46Å | |
| P1A | O3A | sing | 1.61Å | 1.54Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O3A | P2A | sing | 1.61Å | 1.64Å | |
| P2A | O4A | doub | 1.48Å | 1.51Å | |
| P2A | O5A | sing | 1.61Å | 1.48Å | |
| P2A | O6A | sing | 1.61Å | 1.63Å | |
| O5A | HOA5 | sing | 0.97Å | 0.95Å | |
| O6A | CCP | sing | 1.43Å | 1.43Å | |
| CBP | CCP | sing | 1.53Å | 1.54Å | |
| CBP | CDP | sing | 1.53Å | 1.52Å | |
| CBP | CEP | sing | 1.53Å | 1.54Å | |
| CBP | CAP | sing | 1.53Å | 1.52Å | |
| CCP | H121 | sing | 1.09Å | 1.10Å | |
| CCP | H122 | sing | 1.09Å | 1.10Å | |
| CDP | H131 | sing | 1.09Å | 1.10Å | |
| CDP | H132 | sing | 1.09Å | 1.10Å | |
| CDP | H133 | sing | 1.09Å | 1.10Å | |
| CEP | H141 | sing | 1.09Å | 1.10Å | |
| CEP | H142 | sing | 1.09Å | 1.10Å | |
| CEP | H143 | sing | 1.09Å | 1.10Å | |
| CAP | OAP | sing | 1.43Å | 1.43Å | |
| CAP | C9P | sing | 1.51Å | 1.55Å | |
| CAP | H10 | sing | 1.09Å | 1.10Å | |
| OAP | HO1 | sing | 0.97Å | 0.95Å | |
| C9P | O9P | doub | 1.21Å | 1.23Å | |
| C9P | N8P | sing | 1.35Å | 1.47Å | |
| N8P | C7P | sing | 1.46Å | 1.48Å | |
| N8P | HN8 | sing | 0.97Å | 1.00Å | |
| C7P | C6P | sing | 1.53Å | 1.54Å | |
| C7P | H71 | sing | 1.09Å | 1.10Å | |
| C7P | H72 | sing | 1.09Å | 1.10Å | |
| C6P | C5P | sing | 1.51Å | 1.54Å | |
| C6P | H61 | sing | 1.09Å | 1.10Å | |
| C6P | H62 | sing | 1.09Å | 1.10Å | |
| C5P | O5P | doub | 1.21Å | 1.22Å | |
| C5P | N4P | sing | 1.35Å | 1.49Å | |
| N4P | C3P | sing | 1.46Å | 1.48Å | |
| N4P | HN4 | sing | 0.97Å | 1.00Å | |
| C3P | C2P | sing | 1.53Å | 1.54Å | |
| C3P | H31 | sing | 1.09Å | 1.10Å | |
| C3P | H32 | sing | 1.09Å | 1.10Å | |
| C2P | S1P | sing | 1.81Å | 1.78Å | |
| C2P | H21 | sing | 1.09Å | 1.10Å | |
| C2P | H22 | sing | 1.09Å | 1.10Å | |
| S1P | C1B | sing | 1.81Å | 1.80Å | |
| C1B | C2B | sing | 1.51Å | 1.49Å | |
| C1B | H11 | sing | 1.09Å | 1.10Å | |
| C1B | H12 | sing | 1.09Å | 1.10Å | |
| C2B | C3B | doub | 1.38Å | 1.40Å | Aromatic |
| C2B | C7B | sing | 1.38Å | 1.41Å | Aromatic |
| C3B | C4B | sing | 1.38Å | 1.41Å | Aromatic |
| C3B | H3B | sing | 1.08Å | 1.08Å | |
| C4B | C5B | doub | 1.39Å | 1.40Å | Aromatic |
| C4B | H4B | sing | 1.08Å | 1.08Å | |
| C5B | O2B | sing | 1.36Å | 1.36Å | |
| C5B | C6B | sing | 1.39Å | 1.41Å | Aromatic |
| O2B | HO2B | sing | 0.97Å | 0.95Å | |
| C6B | C7B | doub | 1.38Å | 1.41Å | Aromatic |
| C6B | H6B | sing | 1.08Å | 1.08Å | |
| C7B | H7B | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | N1A | C6A | 116.8° | 121.2° |
| N1A | C2A | N3A | 130.2° | 122.4° |
| N1A | C2A | H2A | 114.9° | 118.8° |
| N1A | C6A | C5A | 117.6° | 118.5° |
| N1A | C6A | N6A | 119.3° | 120.8° |
| N3A | C2A | H2A | 114.9° | 118.8° |
| C2A | N3A | C4A | 111.1° | 120.6° |
| N3A | C4A | C5A | 126.8° | 119.1° |
| N3A | C4A | N9A | 127.5° | 134.9° |
| C5A | C4A | N9A | 105.8° | 106.0° |
| C4A | C5A | C6A | 117.5° | 118.2° |
| C4A | C5A | N7A | 111.1° | 107.1° |
| C4A | N9A | C8A | 107.3° | 107.4° |
| C4A | N9A | C1D | 124.4° | 126.3° |
| C6A | C5A | N7A | 131.4° | 134.7° |
| C5A | C6A | N6A | 123.1° | 120.8° |
| C5A | N7A | C8A | 103.6° | 109.4° |
| C6A | N6A | H61A | 125.7° | 120.0° |
| C6A | N6A | H62A | 108.6° | 120.0° |
| H61A | N6A | H62A | 125.7° | 120.0° |
| N7A | C8A | N9A | 112.3° | 110.0° |
| N7A | C8A | H8A | 123.9° | 125.0° |
| N9A | C8A | H8A | 123.9° | 125.0° |
| C8A | N9A | C1D | 128.2° | 126.3° |
| N9A | C1D | C2D | 110.0° | 110.8° |
| N9A | C1D | O4D | 107.0° | 110.6° |
| N9A | C1D | H1D | 110.1° | 110.6° |
| C2D | C1D | O4D | 107.3° | 103.5° |
| C2D | C1D | H1D | 109.8° | 110.6° |
| C1D | C2D | O2D | 106.2° | 110.9° |
| C1D | C2D | C3D | 103.8° | 102.2° |
| C1D | C2D | H2D | 114.3° | 110.9° |
| O4D | C1D | H1D | 112.7° | 110.6° |
| C1D | O4D | C4D | 111.1° | 107.0° |
| O2D | C2D | C3D | 107.3° | 110.9° |
| O2D | C2D | H2D | 111.2° | 110.7° |
| C2D | O2D | HO2A | 109.5° | 106.8° |
| C3D | C2D | H2D | 113.4° | 111.0° |
| C2D | C3D | O3D | 114.0° | 110.5° |
| C2D | C3D | C4D | 101.2° | 104.0° |
| C2D | C3D | H3D | 111.7° | 110.5° |
| O3D | C3D | C4D | 108.5° | 110.8° |
| O3D | C3D | H3D | 104.8° | 110.5° |
| C3D | O3D | P3D | 104.8° | 106.7° |
| C4D | C3D | H3D | 116.9° | 110.5° |
| C3D | C4D | O4D | 104.0° | 107.4° |
| C3D | C4D | C5D | 115.0° | 109.8° |
| C3D | C4D | H4D | 109.0° | 109.9° |
| O3D | P3D | O7A | 111.3° | 109.5° |
| O3D | P3D | O8A | 112.1° | 109.5° |
| O3D | P3D | O9A | 103.6° | 109.5° |
| O7A | P3D | O8A | 107.0° | 109.5° |
| O7A | P3D | O9A | 112.4° | 109.5° |
| O8A | P3D | O9A | 110.5° | 109.5° |
| P3D | O8A | HOA8 | 109.5° | 106.8° |
| P3D | O9A | HOA9 | 109.5° | 106.8° |
| O4D | C4D | C5D | 107.6° | 109.9° |
| O4D | C4D | H4D | 116.2° | 109.9° |
| C5D | C4D | H4D | 105.5° | 109.9° |
| C4D | C5D | O5D | 108.4° | 109.4° |
| C4D | C5D | H51A | 110.1° | 109.5° |
| C4D | C5D | H52A | 109.9° | 109.5° |
| O5D | C5D | H51A | 110.1° | 109.5° |
| O5D | C5D | H52A | 109.8° | 109.4° |
| C5D | O5D | P1A | 117.9° | 106.8° |
| H51A | C5D | H52A | 108.6° | 109.5° |
| O5D | P1A | O1A | 107.8° | 109.4° |
| O5D | P1A | O2A | 111.9° | 109.5° |
| O5D | P1A | O3A | 110.1° | 109.4° |
| O1A | P1A | O2A | 109.9° | 109.5° |
| O1A | P1A | O3A | 110.1° | 109.5° |
| O2A | P1A | O3A | 107.0° | 109.5° |
| P1A | O2A | HOA2 | 109.5° | 106.8° |
| P1A | O3A | P2A | 121.0° | 106.8° |
| O3A | P2A | O4A | 108.0° | 109.5° |
| O3A | P2A | O5A | 110.4° | 109.5° |
| O3A | P2A | O6A | 105.5° | 109.5° |
| O4A | P2A | O5A | 107.4° | 109.5° |
| O4A | P2A | O6A | 116.7° | 109.5° |
| O5A | P2A | O6A | 108.8° | 109.5° |
| P2A | O5A | HOA5 | 109.5° | 106.8° |
| P2A | O6A | CCP | 113.4° | 106.8° |
| O6A | CCP | CBP | 112.5° | 109.5° |
| O6A | CCP | H121 | 107.8° | 109.5° |
| O6A | CCP | H122 | 108.5° | 109.5° |
| CCP | CBP | CDP | 107.9° | 109.5° |
| CCP | CBP | CEP | 109.5° | 109.5° |
| CCP | CBP | CAP | 112.0° | 109.5° |
| CBP | CCP | H121 | 107.8° | 109.5° |
| CBP | CCP | H122 | 108.5° | 109.5° |
| CDP | CBP | CEP | 111.0° | 109.4° |
| CDP | CBP | CAP | 107.8° | 109.5° |
| CBP | CDP | H131 | 109.5° | 109.5° |
| CBP | CDP | H132 | 109.5° | 109.5° |
| CBP | CDP | H133 | 109.5° | 109.5° |
| CEP | CBP | CAP | 108.6° | 109.4° |
| CBP | CEP | H141 | 109.5° | 109.5° |
| CBP | CEP | H142 | 109.5° | 109.4° |
| CBP | CEP | H143 | 109.5° | 109.5° |
| CBP | CAP | OAP | 107.3° | 109.5° |
| CBP | CAP | C9P | 110.0° | 109.4° |
| CBP | CAP | H10 | 110.2° | 109.5° |
| H121 | CCP | H122 | 111.8° | 109.5° |
| H131 | CDP | H132 | 109.5° | 109.5° |
| H131 | CDP | H133 | 109.5° | 109.5° |
| H132 | CDP | H133 | 109.5° | 109.5° |
| H141 | CEP | H142 | 109.5° | 109.4° |
| H141 | CEP | H143 | 109.4° | 109.5° |
| H142 | CEP | H143 | 109.5° | 109.5° |
| OAP | CAP | C9P | 108.6° | 109.5° |
| OAP | CAP | H10 | 111.6° | 109.5° |
| CAP | OAP | HO1 | 109.5° | 106.8° |
| C9P | CAP | H10 | 109.0° | 109.4° |
| CAP | C9P | O9P | 121.0° | 120.0° |
| CAP | C9P | N8P | 119.5° | 120.0° |
| O9P | C9P | N8P | 119.5° | 120.0° |
| C9P | N8P | C7P | 112.7° | 120.0° |
| C9P | N8P | HN8 | 123.7° | 120.0° |
| C7P | N8P | HN8 | 123.7° | 120.0° |
| N8P | C7P | C6P | 108.5° | 109.5° |
| N8P | C7P | H71 | 110.0° | 109.5° |
| N8P | C7P | H72 | 109.8° | 109.5° |
| C6P | C7P | H71 | 110.0° | 109.4° |
| C6P | C7P | H72 | 109.8° | 109.5° |
| C7P | C6P | C5P | 109.8° | 109.5° |
| C7P | C6P | H61 | 109.3° | 109.4° |
| C7P | C6P | H62 | 109.3° | 109.5° |
| H71 | C7P | H72 | 108.8° | 109.4° |
| C5P | C6P | H61 | 109.3° | 109.4° |
| C5P | C6P | H62 | 109.4° | 109.5° |
| C6P | C5P | O5P | 119.7° | 120.0° |
| C6P | C5P | N4P | 118.4° | 120.0° |
| H61 | C6P | H62 | 109.8° | 109.4° |
| O5P | C5P | N4P | 121.8° | 120.0° |
| C5P | N4P | C3P | 111.3° | 120.0° |
| C5P | N4P | HN4 | 124.3° | 120.0° |
| C3P | N4P | HN4 | 124.4° | 120.0° |
| N4P | C3P | C2P | 112.6° | 109.5° |
| N4P | C3P | H31 | 107.8° | 109.5° |
| N4P | C3P | H32 | 108.4° | 109.5° |
| C2P | C3P | H31 | 107.7° | 109.5° |
| C2P | C3P | H32 | 108.5° | 109.4° |
| C3P | C2P | S1P | 115.6° | 109.5° |
| C3P | C2P | H21 | 106.1° | 109.5° |
| C3P | C2P | H22 | 107.5° | 109.5° |
| H31 | C3P | H32 | 111.9° | 109.5° |
| S1P | C2P | H21 | 106.0° | 109.4° |
| S1P | C2P | H22 | 107.5° | 109.4° |
| C2P | S1P | C1B | 112.4° | 100.0° |
| H21 | C2P | H22 | 114.4° | 109.5° |
| S1P | C1B | C2B | 116.6° | 109.4° |
| S1P | C1B | H11 | 105.5° | 109.5° |
| S1P | C1B | H12 | 107.1° | 109.5° |
| C2B | C1B | H11 | 105.6° | 109.5° |
| C2B | C1B | H12 | 107.2° | 109.4° |
| C1B | C2B | C3B | 119.9° | 119.9° |
| C1B | C2B | C7B | 121.4° | 120.0° |
| H11 | C1B | H12 | 115.2° | 109.5° |
| C3B | C2B | C7B | 118.6° | 120.1° |
| C2B | C3B | C4B | 121.9° | 120.1° |
| C2B | C3B | H3B | 119.1° | 120.0° |
| C2B | C7B | C6B | 120.0° | 120.1° |
| C2B | C7B | H7B | 120.0° | 120.0° |
| C4B | C3B | H3B | 119.0° | 119.9° |
| C3B | C4B | C5B | 119.3° | 119.9° |
| C3B | C4B | H4B | 120.4° | 120.1° |
| C5B | C4B | H4B | 120.4° | 120.0° |
| C4B | C5B | O2B | 119.5° | 120.0° |
| C4B | C5B | C6B | 119.6° | 119.9° |
| O2B | C5B | C6B | 120.9° | 120.0° |
| C5B | O2B | HO2B | 109.5° | 106.8° |
| C5B | C6B | C7B | 120.6° | 119.9° |
| C5B | C6B | H6B | 119.7° | 120.0° |
| C7B | C6B | H6B | 119.7° | 120.1° |
| C6B | C7B | H7B | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1A | C2A | N3A | H2A | 180.0° | 180.0° |
| N1A | C2A | N3A | C4A | 0.4° | 0.3° |
| C2A | N1A | C6A | C5A | 0.7° | 0.0° |
| C2A | N1A | C6A | N6A | 180.0° | 180.0° |
| C6A | N1A | C2A | N3A | 0.8° | 0.0° |
| C6A | N1A | C2A | H2A | 179.2° | 180.0° |
| N1A | C6A | C5A | C4A | 0.4° | 0.3° |
| N1A | C6A | C5A | N6A | 179.3° | 180.0° |
| N1A | C6A | C5A | N7A | 178.9° | 180.0° |
| N1A | C6A | N6A | H61A | 179.7° | 180.0° |
| N1A | C6A | N6A | H62A | 0.3° | 0.0° |
| C2A | N3A | C4A | C5A | 0.0° | 0.6° |
| C2A | N3A | C4A | N9A | 179.8° | 179.5° |
| H2A | C2A | N3A | C4A | 179.6° | 179.7° |
| N3A | C4A | C5A | N9A | 179.8° | 179.2° |
| N3A | C4A | C5A | C6A | 0.0° | 0.6° |
| N3A | C4A | C5A | N7A | 178.8° | 179.7° |
| N3A | C4A | N9A | C8A | 179.6° | 179.5° |
| N3A | C4A | N9A | C1D | 1.1° | 0.9° |
| C4A | C5A | C6A | N7A | 178.6° | 179.7° |
| C4A | C5A | C6A | N6A | 179.7° | 179.7° |
| C4A | C5A | N7A | C8A | 1.4° | 0.3° |
| C5A | C4A | N9A | C8A | 0.2° | 0.4° |
| C5A | C4A | N9A | C1D | 178.7° | 179.9° |
| N9A | C4A | C5A | C6A | 179.8° | 179.8° |
| N9A | C4A | C5A | N7A | 1.0° | 0.4° |
| C4A | N9A | C8A | N7A | 0.7° | 0.3° |
| C4A | N9A | C8A | C1D | 178.5° | 179.7° |
| C4A | N9A | C8A | H8A | 179.3° | 179.8° |
| C4A | N9A | C1D | C2D | 77.8° | 89.1° |
| C4A | N9A | C1D | O4D | 166.0° | 156.8° |
| C4A | N9A | C1D | H1D | 43.3° | 34.0° |
| C5A | C6A | N6A | H61A | 0.4° | 0.0° |
| C5A | C6A | N6A | H62A | 179.6° | 180.0° |
| C6A | C5A | N7A | C8A | 180.0° | 180.0° |
| N7A | C5A | C6A | N6A | 1.8° | 0.0° |
| C5A | N7A | C8A | N9A | 1.2° | 0.0° |
| C5A | N7A | C8A | H8A | 178.7° | 180.0° |
| C6A | N6A | H61A | H62A | 180.0° | 180.0° |
| N7A | C8A | N9A | H8A | 180.0° | 180.0° |
| N7A | C8A | N9A | C1D | 177.8° | 179.9° |
| C8A | N9A | C1D | C2D | 100.4° | 90.5° |
| C8A | N9A | C1D | O4D | 15.8° | 23.6° |
| C8A | N9A | C1D | H1D | 138.5° | 146.5° |
| H8A | C8A | N9A | C1D | 2.3° | 0.1° |
| N9A | C1D | C2D | O4D | 116.0° | 118.6° |
| N9A | C1D | C2D | H1D | 121.3° | 123.0° |
| N9A | C1D | O4D | H1D | 121.1° | 122.8° |
| N9A | C1D | C2D | O2D | 150.9° | 86.1° |
| N9A | C1D | C2D | C3D | 96.1° | 155.7° |
| N9A | C1D | C2D | H2D | 27.9° | 37.3° |
| N9A | C1D | O4D | C4D | 120.3° | 158.7° |
| C2D | C1D | O4D | H1D | 120.9° | 118.5° |
| C1D | C2D | O2D | C3D | 110.5° | 112.7° |
| C1D | C2D | O2D | H2D | 124.9° | 123.6° |
| C1D | C2D | C3D | H2D | 124.6° | 118.3° |
| C1D | C2D | O2D | HO2A | 130.8° | 61.4° |
| C1D | C2D | C3D | O3D | 148.9° | 97.9° |
| C1D | C2D | C3D | C4D | 32.6° | 21.0° |
| C1D | C2D | C3D | H3D | 92.5° | 139.5° |
| C2D | C1D | O4D | C4D | 2.3° | 40.0° |
| O4D | C1D | C2D | O2D | 93.1° | 155.3° |
| O4D | C1D | C2D | C3D | 19.9° | 37.1° |
| O4D | C1D | C2D | H2D | 143.9° | 81.2° |
| C1D | O4D | C4D | C3D | 23.6° | 26.4° |
| C1D | O4D | C4D | C5D | 146.0° | 145.9° |
| C1D | O4D | C4D | H4D | 96.1° | 93.1° |
| H1D | C1D | C2D | O2D | 29.7° | 36.8° |
| H1D | C1D | C2D | C3D | 142.6° | 81.3° |
| H1D | C1D | C2D | H2D | 93.4° | 160.3° |
| H1D | C1D | O4D | C4D | 118.6° | 78.4° |
| O2D | C2D | C3D | H2D | 123.2° | 123.5° |
| O2D | C2D | C3D | O3D | 36.7° | 20.3° |
| O2D | C2D | C3D | C4D | 79.6° | 139.2° |
| O2D | C2D | C3D | H3D | 155.3° | 102.3° |
| C3D | C2D | O2D | HO2A | 20.3° | 174.2° |
| C2D | C3D | O3D | C4D | 111.9° | 114.7° |
| C2D | C3D | O3D | H3D | 122.5° | 122.6° |
| C2D | C3D | C4D | H3D | 121.6° | 118.6° |
| C2D | C3D | O3D | P3D | 93.3° | 121.5° |
| C2D | C3D | C4D | O4D | 34.1° | 1.9° |
| C2D | C3D | C4D | C5D | 151.4° | 121.4° |
| C2D | C3D | C4D | H4D | 90.4° | 117.6° |
| H2D | C2D | O2D | HO2A | 104.3° | 62.2° |
| H2D | C2D | C3D | O3D | 86.5° | 143.8° |
| H2D | C2D | C3D | C4D | 157.2° | 97.3° |
| H2D | C2D | C3D | H3D | 32.1° | 21.3° |
| O3D | C3D | C4D | H3D | 118.2° | 122.8° |
| C3D | O3D | P3D | O7A | 77.5° | 55.0° |
| C3D | O3D | P3D | O8A | 42.4° | 175.0° |
| C3D | O3D | P3D | O9A | 161.6° | 65.0° |
| O3D | C3D | C4D | O4D | 154.4° | 120.6° |
| O3D | C3D | C4D | C5D | 88.3° | 119.9° |
| O3D | C3D | C4D | H4D | 29.8° | 1.1° |
| C4D | C3D | O3D | P3D | 154.8° | 123.8° |
| C3D | C4D | O4D | C5D | 122.4° | 119.5° |
| C3D | C4D | O4D | H4D | 119.7° | 119.5° |
| C3D | C4D | C5D | H4D | 120.1° | 121.0° |
| C3D | C4D | C5D | O5D | 47.9° | 175.3° |
| C3D | C4D | C5D | H51A | 72.6° | 64.7° |
| C3D | C4D | C5D | H52A | 167.9° | 55.3° |
| H3D | C3D | O3D | P3D | 29.2° | 1.1° |
| H3D | C3D | C4D | O4D | 87.5° | 116.6° |
| H3D | C3D | C4D | C5D | 29.9° | 2.8° |
| H3D | C3D | C4D | H4D | 148.0° | 123.8° |
| O3D | P3D | O7A | O8A | 122.8° | 120.0° |
| O3D | P3D | O7A | O9A | 115.7° | 120.0° |
| O3D | P3D | O8A | O9A | 115.0° | 120.0° |
| O3D | P3D | O8A | HOA8 | 70.0° | 180.0° |
| O3D | P3D | O9A | HOA9 | 120.9° | 60.0° |
| O7A | P3D | O8A | O9A | 122.6° | 120.0° |
| O7A | P3D | O8A | HOA8 | 52.3° | 60.0° |
| O7A | P3D | O9A | HOA9 | 118.9° | 180.0° |
| O8A | P3D | O9A | HOA9 | 0.6° | 60.0° |
| O9A | P3D | O8A | HOA8 | 174.9° | 60.0° |
| O4D | C4D | C5D | H4D | 124.6° | 121.0° |
| O4D | C4D | C5D | O5D | 67.4° | 66.7° |
| O4D | C4D | C5D | H51A | 172.2° | 53.3° |
| O4D | C4D | C5D | H52A | 52.6° | 173.3° |
| C4D | C5D | O5D | H51A | 120.4° | 120.0° |
| C4D | C5D | O5D | H52A | 120.0° | 119.9° |
| C4D | C5D | H51A | H52A | 120.3° | 120.0° |
| C4D | C5D | O5D | P1A | 164.5° | 180.0° |
| H4D | C4D | C5D | O5D | 168.0° | 54.3° |
| H4D | C4D | C5D | H51A | 47.5° | 174.3° |
| H4D | C4D | C5D | H52A | 72.0° | 65.7° |
| O5D | C5D | H51A | H52A | 120.3° | 120.0° |
| C5D | O5D | P1A | O1A | 152.3° | 55.0° |
| C5D | O5D | P1A | O2A | 86.8° | 65.0° |
| C5D | O5D | P1A | O3A | 32.1° | 174.9° |
| H51A | C5D | O5D | P1A | 75.1° | 60.0° |
| H52A | C5D | O5D | P1A | 44.4° | 60.0° |
| O5D | P1A | O1A | O2A | 122.2° | 120.0° |
| O5D | P1A | O1A | O3A | 120.1° | 119.9° |
| O5D | P1A | O2A | O3A | 120.7° | 120.0° |
| O5D | P1A | O2A | HOA2 | 139.9° | 60.0° |
| O5D | P1A | O3A | P2A | 117.7° | 160.0° |
| O1A | P1A | O2A | O3A | 119.6° | 120.0° |
| O1A | P1A | O2A | HOA2 | 20.2° | 180.0° |
| O1A | P1A | O3A | P2A | 1.1° | 40.1° |
| O2A | P1A | O3A | P2A | 120.5° | 80.0° |
| O3A | P1A | O2A | HOA2 | 99.4° | 60.0° |
| P1A | O3A | P2A | O4A | 176.6° | 40.0° |
| P1A | O3A | P2A | O5A | 59.4° | 80.0° |
| P1A | O3A | P2A | O6A | 57.9° | 160.0° |
| O3A | P2A | O4A | O5A | 119.1° | 120.0° |
| O3A | P2A | O4A | O6A | 118.5° | 120.0° |
| O3A | P2A | O5A | O6A | 115.3° | 120.0° |
| O3A | P2A | O5A | HOA5 | 144.1° | 60.0° |
| O3A | P2A | O6A | CCP | 141.2° | 175.0° |
| O4A | P2A | O5A | O6A | 127.2° | 120.0° |
| O4A | P2A | O5A | HOA5 | 98.4° | 180.0° |
| O4A | P2A | O6A | CCP | 21.2° | 55.0° |
| O5A | P2A | O6A | CCP | 100.4° | 65.0° |
| O6A | P2A | O5A | HOA5 | 28.8° | 60.0° |
| P2A | O6A | CCP | CBP | 122.9° | 180.0° |
| P2A | O6A | CCP | H121 | 118.4° | 60.0° |
| P2A | O6A | CCP | H122 | 2.9° | 60.0° |
| O6A | CCP | CBP | H121 | 118.7° | 120.0° |
| O6A | CCP | CBP | H122 | 120.0° | 120.0° |
| O6A | CCP | CBP | CDP | 74.9° | 60.0° |
| O6A | CCP | CBP | CEP | 164.1° | 60.0° |
| O6A | CCP | CBP | CAP | 43.6° | 180.0° |
| O6A | CCP | H121 | H122 | 119.2° | 120.0° |
| CCP | CBP | CDP | CEP | 120.0° | 120.0° |
| CCP | CBP | CDP | CAP | 121.2° | 120.1° |
| CCP | CBP | CEP | CAP | 122.6° | 120.0° |
| CBP | CCP | H121 | H122 | 119.2° | 120.0° |
| CCP | CBP | CDP | H131 | 137.8° | 172.7° |
| CCP | CBP | CDP | H132 | 17.8° | 52.7° |
| CCP | CBP | CDP | H133 | 102.3° | 67.3° |
| CCP | CBP | CEP | H141 | 172.5° | 56.5° |
| CCP | CBP | CEP | H142 | 52.5° | 63.5° |
| CCP | CBP | CEP | H143 | 67.5° | 176.5° |
| CCP | CBP | CAP | OAP | 59.4° | 65.4° |
| CCP | CBP | CAP | C9P | 177.4° | 54.6° |
| CCP | CBP | CAP | H10 | 62.4° | 174.5° |
| CDP | CBP | CEP | CAP | 118.3° | 120.0° |
| CDP | CBP | CCP | H121 | 43.8° | 60.0° |
| CDP | CBP | CCP | H122 | 165.1° | 180.0° |
| CBP | CDP | H131 | H132 | 120.0° | 120.0° |
| CBP | CDP | H131 | H133 | 120.0° | 120.0° |
| CBP | CDP | H132 | H133 | 120.0° | 120.0° |
| CDP | CBP | CEP | H141 | 53.4° | 63.5° |
| CDP | CBP | CEP | H142 | 66.5° | 176.5° |
| CDP | CBP | CEP | H143 | 173.4° | 56.5° |
| CDP | CBP | CAP | OAP | 177.9° | 174.5° |
| CDP | CBP | CAP | C9P | 64.1° | 65.5° |
| CDP | CBP | CAP | H10 | 56.2° | 54.5° |
| CEP | CBP | CCP | H121 | 77.2° | 180.0° |
| CEP | CBP | CCP | H122 | 44.1° | 60.0° |
| CEP | CBP | CDP | H131 | 102.2° | 67.3° |
| CEP | CBP | CDP | H132 | 137.8° | 172.7° |
| CEP | CBP | CDP | H133 | 17.8° | 52.7° |
| CBP | CEP | H141 | H142 | 120.0° | 120.0° |
| CBP | CEP | H141 | H143 | 120.0° | 120.1° |
| CBP | CEP | H142 | H143 | 120.1° | 120.0° |
| CEP | CBP | CAP | OAP | 61.7° | 54.6° |
| CEP | CBP | CAP | C9P | 56.3° | 174.6° |
| CEP | CBP | CAP | H10 | 176.5° | 65.5° |
| CAP | CBP | CCP | H121 | 162.3° | 60.0° |
| CAP | CBP | CCP | H122 | 76.4° | 60.0° |
| CAP | CBP | CDP | H131 | 16.6° | 52.6° |
| CAP | CBP | CDP | H132 | 103.4° | 67.4° |
| CAP | CBP | CDP | H133 | 136.6° | 172.6° |
| CAP | CBP | CEP | H141 | 64.9° | 176.5° |
| CAP | CBP | CEP | H142 | 175.2° | 56.5° |
| CAP | CBP | CEP | H143 | 55.1° | 63.5° |
| CBP | CAP | OAP | C9P | 118.9° | 120.0° |
| CBP | CAP | OAP | H10 | 120.9° | 120.1° |
| CBP | CAP | C9P | H10 | 121.0° | 120.0° |
| CBP | CAP | OAP | HO1 | 135.9° | 60.0° |
| CBP | CAP | C9P | O9P | 74.8° | 105.9° |
| CBP | CAP | C9P | N8P | 106.3° | 74.1° |
| H131 | CDP | H132 | H133 | 120.0° | 120.0° |
| H141 | CEP | H142 | H143 | 119.9° | 120.0° |
| OAP | CAP | C9P | H10 | 121.8° | 120.0° |
| OAP | CAP | C9P | O9P | 168.1° | 14.1° |
| OAP | CAP | C9P | N8P | 10.9° | 165.9° |
| C9P | CAP | OAP | HO1 | 105.2° | 60.0° |
| CAP | C9P | O9P | N8P | 178.9° | 180.0° |
| CAP | C9P | N8P | C7P | 177.4° | 178.8° |
| CAP | C9P | N8P | HN8 | 2.5° | 1.2° |
| H10 | CAP | OAP | HO1 | 15.0° | 180.0° |
| H10 | CAP | C9P | O9P | 46.2° | 134.1° |
| H10 | CAP | C9P | N8P | 132.7° | 45.9° |
| O9P | C9P | N8P | C7P | 1.5° | 1.2° |
| O9P | C9P | N8P | HN8 | 178.5° | 178.8° |
| C9P | N8P | C7P | HN8 | 180.0° | 180.0° |
| C9P | N8P | C7P | C6P | 90.7° | 180.0° |
| C9P | N8P | C7P | H71 | 148.9° | 60.0° |
| C9P | N8P | C7P | H72 | 29.3° | 60.0° |
| N8P | C7P | C6P | H71 | 120.4° | 120.0° |
| N8P | C7P | C6P | H72 | 120.0° | 120.1° |
| N8P | C7P | H71 | H72 | 120.2° | 120.1° |
| N8P | C7P | C6P | C5P | 166.8° | 180.0° |
| N8P | C7P | C6P | H61 | 73.4° | 60.0° |
| N8P | C7P | C6P | H62 | 46.8° | 59.9° |
| HN8 | N8P | C7P | C6P | 89.4° | 0.0° |
| HN8 | N8P | C7P | H71 | 31.0° | 120.0° |
| HN8 | N8P | C7P | H72 | 150.6° | 120.0° |
| C6P | C7P | H71 | H72 | 120.3° | 119.9° |
| C7P | C6P | C5P | H61 | 119.8° | 120.0° |
| C7P | C6P | C5P | H62 | 120.0° | 120.1° |
| C7P | C6P | H61 | H62 | 119.9° | 120.0° |
| C7P | C6P | C5P | O5P | 28.5° | 0.1° |
| C7P | C6P | C5P | N4P | 154.3° | 180.0° |
| H71 | C7P | C6P | C5P | 46.4° | 60.0° |
| H71 | C7P | C6P | H61 | 166.3° | 180.0° |
| H71 | C7P | C6P | H62 | 73.6° | 60.1° |
| H72 | C7P | C6P | C5P | 73.3° | 59.9° |
| H72 | C7P | C6P | H61 | 46.6° | 60.1° |
| H72 | C7P | C6P | H62 | 166.8° | 180.0° |
| C5P | C6P | H61 | H62 | 119.9° | 120.0° |
| C6P | C5P | O5P | N4P | 177.1° | 179.9° |
| C6P | C5P | N4P | C3P | 179.9° | 180.0° |
| C6P | C5P | N4P | HN4 | 0.1° | 0.1° |
| H61 | C6P | C5P | O5P | 91.3° | 120.0° |
| H61 | C6P | C5P | N4P | 85.8° | 60.1° |
| H62 | C6P | C5P | O5P | 148.5° | 120.0° |
| H62 | C6P | C5P | N4P | 34.4° | 59.9° |
| O5P | C5P | N4P | C3P | 2.8° | 0.1° |
| O5P | C5P | N4P | HN4 | 177.2° | 180.0° |
| C5P | N4P | C3P | HN4 | 180.0° | 179.9° |
| C5P | N4P | C3P | C2P | 83.5° | 180.0° |
| C5P | N4P | C3P | H31 | 157.8° | 60.0° |
| C5P | N4P | C3P | H32 | 36.5° | 60.0° |
| N4P | C3P | C2P | H31 | 118.7° | 120.0° |
| N4P | C3P | C2P | H32 | 120.0° | 120.0° |
| N4P | C3P | H31 | H32 | 119.1° | 120.0° |
| N4P | C3P | C2P | S1P | 73.5° | 180.0° |
| N4P | C3P | C2P | H21 | 169.3° | 60.0° |
| N4P | C3P | C2P | H22 | 46.6° | 60.0° |
| HN4 | N4P | C3P | C2P | 96.5° | 0.0° |
| HN4 | N4P | C3P | H31 | 22.2° | 120.1° |
| HN4 | N4P | C3P | H32 | 143.5° | 119.9° |
| C2P | C3P | H31 | H32 | 119.2° | 120.0° |
| C3P | C2P | S1P | H21 | 117.2° | 120.0° |
| C3P | C2P | S1P | H22 | 120.0° | 120.0° |
| C3P | C2P | H21 | H22 | 118.3° | 120.1° |
| C3P | C2P | S1P | C1B | 80.1° | 180.0° |
| H31 | C3P | C2P | S1P | 45.2° | 60.0° |
| H31 | C3P | C2P | H21 | 72.0° | 180.0° |
| H31 | C3P | C2P | H22 | 165.2° | 60.0° |
| H32 | C3P | C2P | S1P | 166.6° | 60.0° |
| H32 | C3P | C2P | H21 | 49.4° | 60.0° |
| H32 | C3P | C2P | H22 | 73.4° | 180.0° |
| S1P | C2P | H21 | H22 | 118.3° | 119.9° |
| C2P | S1P | C1B | C2B | 122.6° | 180.0° |
| C2P | S1P | C1B | H11 | 120.6° | 60.0° |
| C2P | S1P | C1B | H12 | 2.6° | 60.1° |
| H21 | C2P | S1P | C1B | 37.1° | 60.0° |
| H22 | C2P | S1P | C1B | 159.9° | 60.0° |
| S1P | C1B | C2B | H11 | 116.8° | 120.0° |
| S1P | C1B | C2B | H12 | 120.0° | 119.9° |
| S1P | C1B | H11 | H12 | 118.0° | 120.0° |
| S1P | C1B | C2B | C3B | 155.2° | 90.0° |
| S1P | C1B | C2B | C7B | 20.9° | 90.2° |
| C2B | C1B | H11 | H12 | 118.0° | 120.0° |
| C1B | C2B | C3B | C7B | 176.1° | 179.7° |
| C1B | C2B | C3B | C4B | 176.9° | 180.0° |
| C1B | C2B | C3B | H3B | 3.1° | 0.0° |
| C1B | C2B | C7B | C6B | 176.4° | 179.7° |
| C1B | C2B | C7B | H7B | 3.6° | 0.2° |
| H11 | C1B | C2B | C3B | 88.1° | 30.0° |
| H11 | C1B | C2B | C7B | 95.9° | 149.7° |
| H12 | C1B | C2B | C3B | 35.2° | 150.0° |
| H12 | C1B | C2B | C7B | 140.8° | 29.7° |
| C2B | C3B | C4B | H3B | 180.0° | 180.0° |
| C2B | C3B | C4B | C5B | 0.0° | 0.0° |
| C2B | C3B | C4B | H4B | 180.0° | 179.9° |
| C3B | C2B | C7B | C6B | 0.3° | 0.5° |
| C3B | C2B | C7B | H7B | 179.7° | 179.9° |
| C7B | C2B | C3B | C4B | 0.8° | 0.3° |
| C7B | C2B | C3B | H3B | 179.2° | 179.7° |
| C2B | C7B | C6B | C5B | 0.9° | 0.5° |
| C2B | C7B | C6B | H7B | 180.0° | 179.5° |
| C2B | C7B | C6B | H6B | 179.1° | 179.7° |
| C3B | C4B | C5B | H4B | 180.0° | 179.9° |
| C3B | C4B | C5B | O2B | 177.9° | 180.0° |
| C3B | C4B | C5B | C6B | 1.3° | 0.0° |
| H3B | C3B | C4B | C5B | 180.0° | 180.0° |
| H3B | C3B | C4B | H4B | 0.0° | 0.1° |
| C4B | C5B | O2B | C6B | 179.2° | 180.0° |
| C4B | C5B | O2B | HO2B | 57.8° | 90.0° |
| C4B | C5B | C6B | C7B | 1.7° | 0.3° |
| C4B | C5B | C6B | H6B | 178.3° | 180.0° |
| H4B | C4B | C5B | O2B | 2.1° | 0.1° |
| H4B | C4B | C5B | C6B | 178.7° | 179.9° |
| O2B | C5B | C6B | C7B | 177.4° | 179.7° |
| O2B | C5B | C6B | H6B | 2.6° | 0.0° |
| C6B | C5B | O2B | HO2B | 121.4° | 90.0° |
| C5B | C6B | C7B | H6B | 180.0° | 179.7° |
| C5B | C6B | C7B | H7B | 179.0° | 180.0° |
| H6B | C6B | C7B | H7B | 0.9° | 0.2° |
