CO8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1A | C2A | sing | 1.32Å | 1.34Å | Aromatic |
| N1A | C6A | doub | 1.33Å | 1.37Å | Aromatic |
| C2A | N3A | doub | 1.32Å | 1.34Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.10Å | |
| N3A | C4A | sing | 1.33Å | 1.40Å | Aromatic |
| C4A | C5A | doub | 1.41Å | 1.38Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.39Å | Aromatic |
| C5A | C6A | sing | 1.41Å | 1.43Å | Aromatic |
| C5A | N7A | sing | 1.35Å | 1.37Å | Aromatic |
| C6A | N6A | sing | 1.38Å | 1.33Å | |
| N6A | H61A | sing | 0.97Å | 1.02Å | |
| N6A | H62A | sing | 0.97Å | 1.02Å | |
| N7A | C8A | doub | 1.30Å | 1.32Å | Aromatic |
| C8A | N9A | sing | 1.36Å | 1.39Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.10Å | |
| N9A | C1B | sing | 1.46Å | 1.49Å | |
| C1B | C2B | sing | 1.55Å | 1.55Å | |
| C1B | O4B | sing | 1.44Å | 1.44Å | |
| C1B | H1B | sing | 1.09Å | 1.11Å | |
| C2B | O2B | sing | 1.43Å | 1.45Å | |
| C2B | C3B | sing | 1.55Å | 1.55Å | |
| C2B | H2B | sing | 1.09Å | 1.12Å | |
| O2B | HO2A | sing | 0.97Å | 0.95Å | |
| C3B | O3B | sing | 1.43Å | 1.45Å | |
| C3B | C4B | sing | 1.54Å | 1.54Å | |
| C3B | H3B | sing | 1.09Å | 1.11Å | |
| O3B | P3B | sing | 1.61Å | 1.54Å | |
| P3B | O7A | doub | 1.48Å | 1.54Å | |
| P3B | O8A | sing | 1.61Å | 1.56Å | |
| P3B | O9A | sing | 1.61Å | 1.55Å | |
| O8A | HOA8 | sing | 0.97Å | 0.95Å | |
| O9A | HOA9 | sing | 0.97Å | 0.95Å | |
| C4B | O4B | sing | 1.44Å | 1.44Å | |
| C4B | C5B | sing | 1.53Å | 1.52Å | |
| C4B | H4B | sing | 1.09Å | 1.11Å | |
| C5B | O5B | sing | 1.43Å | 1.42Å | |
| C5B | H51A | sing | 1.09Å | 1.12Å | |
| C5B | H52A | sing | 1.09Å | 1.11Å | |
| O5B | P1A | sing | 1.61Å | 1.54Å | |
| P1A | O1A | doub | 1.48Å | 1.55Å | |
| P1A | O2A | sing | 1.61Å | 1.55Å | |
| P1A | O3A | sing | 1.61Å | 1.54Å | |
| O2A | HOA2 | sing | 0.97Å | 0.95Å | |
| O3A | P2A | sing | 1.61Å | 1.54Å | |
| P2A | O4A | doub | 1.48Å | 1.56Å | |
| P2A | O5A | sing | 1.61Å | 1.55Å | |
| P2A | O6A | sing | 1.61Å | 1.55Å | |
| O5A | HOA5 | sing | 0.97Å | 0.95Å | |
| O6A | CCP | sing | 1.43Å | 1.44Å | |
| CBP | CCP | sing | 1.53Å | 1.53Å | |
| CBP | CDP | sing | 1.53Å | 1.54Å | |
| CBP | CEP | sing | 1.53Å | 1.54Å | |
| CBP | CAP | sing | 1.53Å | 1.56Å | |
| CCP | H121 | sing | 1.09Å | 1.11Å | |
| CCP | H122 | sing | 1.09Å | 1.12Å | |
| CDP | H131 | sing | 1.09Å | 1.12Å | |
| CDP | H132 | sing | 1.09Å | 1.11Å | |
| CDP | H133 | sing | 1.09Å | 1.11Å | |
| CEP | H141 | sing | 1.09Å | 1.12Å | |
| CEP | H142 | sing | 1.09Å | 1.11Å | |
| CEP | H143 | sing | 1.09Å | 1.12Å | |
| CAP | OAP | sing | 1.43Å | 1.44Å | |
| CAP | C9P | sing | 1.51Å | 1.55Å | |
| CAP | H10 | sing | 1.09Å | 1.12Å | |
| OAP | HO1 | sing | 0.97Å | 0.95Å | |
| C9P | O9P | doub | 1.21Å | 1.24Å | |
| C9P | N8P | sing | 1.35Å | 1.42Å | |
| N8P | C7P | sing | 1.46Å | 1.42Å | |
| N8P | HN8 | sing | 0.97Å | 1.02Å | |
| C7P | C6P | sing | 1.53Å | 1.51Å | |
| C7P | H71 | sing | 1.09Å | 1.12Å | |
| C7P | H72 | sing | 1.09Å | 1.11Å | |
| C6P | C5P | sing | 1.51Å | 1.51Å | |
| C6P | H61 | sing | 1.09Å | 1.11Å | |
| C6P | H62 | sing | 1.09Å | 1.12Å | |
| C5P | O5P | doub | 1.21Å | 1.24Å | |
| C5P | N4P | sing | 1.35Å | 1.43Å | |
| N4P | C3P | sing | 1.46Å | 1.42Å | |
| N4P | HN4 | sing | 0.97Å | 1.02Å | |
| C3P | C2P | sing | 1.53Å | 1.51Å | |
| C3P | H31 | sing | 1.09Å | 1.12Å | |
| C3P | H32 | sing | 1.09Å | 1.12Å | |
| C2P | S1P | sing | 1.81Å | 1.83Å | |
| C2P | H21 | sing | 1.09Å | 1.11Å | |
| C2P | H22 | sing | 1.09Å | 1.11Å | |
| S1P | C1' | sing | 1.71Å | 1.79Å | |
| C1' | O1' | doub | 1.21Å | 1.23Å | |
| C1' | C2' | sing | 1.51Å | 1.51Å | |
| C2' | C3' | sing | 1.53Å | 1.51Å | |
| C2' | H2'1 | sing | 1.09Å | 1.12Å | |
| C2' | H2'2 | sing | 1.09Å | 1.12Å | |
| C3' | C4' | sing | 1.53Å | 1.51Å | |
| C3' | H3'1 | sing | 1.09Å | 1.11Å | |
| C3' | H3'2 | sing | 1.09Å | 1.12Å | |
| C4' | C5' | sing | 1.53Å | 1.51Å | |
| C4' | H4'1 | sing | 1.09Å | 1.11Å | |
| C4' | H4'2 | sing | 1.09Å | 1.11Å | |
| C5' | C6' | sing | 1.53Å | 1.51Å | |
| C5' | H5'1 | sing | 1.09Å | 1.12Å | |
| C5' | H5'2 | sing | 1.09Å | 1.12Å | |
| C6' | C7' | sing | 1.53Å | 1.51Å | |
| C6' | H6'1 | sing | 1.09Å | 1.11Å | |
| C6' | H6'2 | sing | 1.09Å | 1.12Å | |
| C7' | C8' | sing | 1.53Å | 1.50Å | |
| C7' | H7'1 | sing | 1.09Å | 1.12Å | |
| C7' | H7'2 | sing | 1.09Å | 1.11Å | |
| C8' | H8'1 | sing | 1.09Å | 1.11Å | |
| C8' | H8'2 | sing | 1.09Å | 1.11Å | |
| C8' | H8'3 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | N1A | C6A | 119.5° | 121.3° |
| N1A | C2A | N3A | 127.9° | 122.4° |
| N1A | C2A | H2A | 115.9° | 118.8° |
| N1A | C6A | C5A | 118.6° | 118.4° |
| N1A | C6A | N6A | 118.9° | 120.8° |
| N3A | C2A | H2A | 116.2° | 118.8° |
| C2A | N3A | C4A | 111.9° | 120.6° |
| N3A | C4A | C5A | 125.8° | 119.1° |
| N3A | C4A | N9A | 128.3° | 134.9° |
| C5A | C4A | N9A | 105.9° | 106.0° |
| C4A | C5A | C6A | 116.3° | 118.2° |
| C4A | C5A | N7A | 111.5° | 107.1° |
| C4A | N9A | C8A | 104.9° | 107.4° |
| C4A | N9A | C1B | 126.4° | 126.3° |
| C6A | C5A | N7A | 132.2° | 134.7° |
| C5A | C6A | N6A | 122.5° | 120.8° |
| C5A | N7A | C8A | 104.0° | 109.5° |
| C6A | N6A | H61A | 118.9° | 120.0° |
| C6A | N6A | H62A | 108.9° | 120.0° |
| H61A | N6A | H62A | 108.8° | 120.0° |
| N7A | C8A | N9A | 113.7° | 109.9° |
| N7A | C8A | H8A | 120.9° | 125.1° |
| N9A | C8A | H8A | 125.4° | 125.0° |
| C8A | N9A | C1B | 128.7° | 126.3° |
| N9A | C1B | C2B | 108.8° | 110.8° |
| N9A | C1B | O4B | 112.4° | 110.6° |
| N9A | C1B | H1B | 106.1° | 110.5° |
| C2B | C1B | O4B | 103.1° | 103.5° |
| C2B | C1B | H1B | 115.0° | 110.6° |
| C1B | C2B | O2B | 111.3° | 110.9° |
| C1B | C2B | C3B | 102.0° | 102.1° |
| C1B | C2B | H2B | 113.4° | 110.9° |
| O4B | C1B | H1B | 111.6° | 110.6° |
| C1B | O4B | C4B | 108.6° | 107.0° |
| O2B | C2B | C3B | 110.4° | 110.9° |
| O2B | C2B | H2B | 105.5° | 110.8° |
| C2B | O2B | HO2A | 111.3° | 106.8° |
| C3B | C2B | H2B | 114.4° | 111.0° |
| C2B | C3B | O3B | 110.6° | 110.5° |
| C2B | C3B | C4B | 99.2° | 104.0° |
| C2B | C3B | H3B | 114.9° | 110.4° |
| O3B | C3B | C4B | 108.3° | 110.8° |
| O3B | C3B | H3B | 106.8° | 110.4° |
| C3B | O3B | P3B | 119.3° | 106.8° |
| C4B | C3B | H3B | 116.9° | 110.5° |
| C3B | C4B | O4B | 109.2° | 107.4° |
| C3B | C4B | C5B | 110.1° | 109.9° |
| C3B | C4B | H4B | 109.5° | 109.9° |
| O3B | P3B | O7A | 108.5° | 109.5° |
| O3B | P3B | O8A | 110.3° | 109.5° |
| O3B | P3B | O9A | 108.6° | 109.5° |
| O7A | P3B | O8A | 110.9° | 109.5° |
| O7A | P3B | O9A | 108.9° | 109.5° |
| O8A | P3B | O9A | 109.7° | 109.5° |
| P3B | O8A | HOA8 | 110.2° | 106.8° |
| P3B | O9A | HOA9 | 108.5° | 106.8° |
| O4B | C4B | C5B | 110.4° | 109.9° |
| O4B | C4B | H4B | 109.2° | 109.9° |
| C5B | C4B | H4B | 108.4° | 109.9° |
| C4B | C5B | O5B | 113.0° | 109.5° |
| C4B | C5B | H51A | 110.9° | 109.4° |
| C4B | C5B | H52A | 110.9° | 109.4° |
| O5B | C5B | H51A | 110.8° | 109.6° |
| O5B | C5B | H52A | 110.9° | 109.4° |
| C5B | O5B | P1A | 120.9° | 106.8° |
| H51A | C5B | H52A | 99.5° | 109.5° |
| O5B | P1A | O1A | 110.7° | 109.5° |
| O5B | P1A | O2A | 108.8° | 109.5° |
| O5B | P1A | O3A | 108.4° | 109.5° |
| O1A | P1A | O2A | 109.8° | 109.4° |
| O1A | P1A | O3A | 108.6° | 109.4° |
| O2A | P1A | O3A | 110.5° | 109.5° |
| P1A | O2A | HOA2 | 108.8° | 106.8° |
| P1A | O3A | P2A | 128.7° | 106.8° |
| O3A | P2A | O4A | 109.2° | 109.5° |
| O3A | P2A | O5A | 109.7° | 109.5° |
| O3A | P2A | O6A | 108.8° | 109.5° |
| O4A | P2A | O5A | 109.8° | 109.4° |
| O4A | P2A | O6A | 109.7° | 109.5° |
| O5A | P2A | O6A | 109.6° | 109.5° |
| P2A | O5A | HOA5 | 109.7° | 106.7° |
| P2A | O6A | CCP | 119.6° | 106.8° |
| O6A | CCP | CBP | 114.2° | 109.5° |
| O6A | CCP | H121 | 110.5° | 109.5° |
| O6A | CCP | H122 | 110.5° | 109.5° |
| CCP | CBP | CDP | 107.7° | 109.5° |
| CCP | CBP | CEP | 108.9° | 109.5° |
| CCP | CBP | CAP | 108.5° | 109.5° |
| CBP | CCP | H121 | 110.4° | 109.4° |
| CBP | CCP | H122 | 110.4° | 109.5° |
| CDP | CBP | CEP | 109.8° | 109.5° |
| CDP | CBP | CAP | 111.1° | 109.4° |
| CBP | CDP | H131 | 107.7° | 109.4° |
| CBP | CDP | H132 | 112.9° | 109.5° |
| CBP | CDP | H133 | 112.9° | 109.5° |
| CEP | CBP | CAP | 110.7° | 109.5° |
| CBP | CEP | H141 | 108.9° | 109.4° |
| CBP | CEP | H142 | 112.4° | 109.4° |
| CBP | CEP | H143 | 112.4° | 109.5° |
| CBP | CAP | OAP | 110.8° | 109.5° |
| CBP | CAP | C9P | 115.9° | 109.5° |
| CBP | CAP | H10 | 102.8° | 109.5° |
| H121 | CCP | H122 | 99.8° | 109.4° |
| H131 | CDP | H132 | 112.9° | 109.4° |
| H131 | CDP | H133 | 112.8° | 109.5° |
| H132 | CDP | H133 | 97.6° | 109.5° |
| H141 | CEP | H142 | 112.4° | 109.5° |
| H141 | CEP | H143 | 112.4° | 109.5° |
| H142 | CEP | H143 | 98.1° | 109.5° |
| OAP | CAP | C9P | 105.4° | 109.5° |
| OAP | CAP | H10 | 113.8° | 109.5° |
| CAP | OAP | HO1 | 110.7° | 106.8° |
| C9P | CAP | H10 | 108.4° | 109.5° |
| CAP | C9P | O9P | 120.8° | 120.0° |
| CAP | C9P | N8P | 116.8° | 120.0° |
| O9P | C9P | N8P | 122.4° | 120.0° |
| C9P | N8P | C7P | 123.8° | 120.0° |
| C9P | N8P | HN8 | 118.2° | 120.0° |
| C7P | N8P | HN8 | 118.0° | 119.9° |
| N8P | C7P | C6P | 112.1° | 109.5° |
| N8P | C7P | H71 | 111.2° | 109.4° |
| N8P | C7P | H72 | 111.2° | 109.5° |
| C6P | C7P | H71 | 111.2° | 109.5° |
| C6P | C7P | H72 | 111.2° | 109.5° |
| C7P | C6P | C5P | 112.4° | 109.5° |
| C7P | C6P | H61 | 111.2° | 109.4° |
| C7P | C6P | H62 | 111.2° | 109.5° |
| H71 | C7P | H72 | 99.1° | 109.4° |
| C5P | C6P | H61 | 111.1° | 109.5° |
| C5P | C6P | H62 | 111.1° | 109.6° |
| C6P | C5P | O5P | 122.2° | 120.0° |
| C6P | C5P | N4P | 112.5° | 120.0° |
| H61 | C6P | H62 | 99.2° | 109.4° |
| O5P | C5P | N4P | 125.3° | 120.0° |
| C5P | N4P | C3P | 122.9° | 120.0° |
| C5P | N4P | HN4 | 119.1° | 120.0° |
| C3P | N4P | HN4 | 118.0° | 120.0° |
| N4P | C3P | C2P | 111.4° | 109.5° |
| N4P | C3P | H31 | 111.5° | 109.5° |
| N4P | C3P | H32 | 111.5° | 109.5° |
| C2P | C3P | H31 | 111.5° | 109.5° |
| C2P | C3P | H32 | 111.5° | 109.4° |
| C3P | C2P | S1P | 114.2° | 109.5° |
| C3P | C2P | H21 | 110.5° | 109.5° |
| C3P | C2P | H22 | 110.5° | 109.4° |
| H31 | C3P | H32 | 98.8° | 109.4° |
| S1P | C2P | H21 | 110.4° | 109.4° |
| S1P | C2P | H22 | 110.5° | 109.5° |
| C2P | S1P | C1' | 105.2° | 100.0° |
| H21 | C2P | H22 | 99.9° | 109.5° |
| S1P | C1' | O1' | 117.1° | 120.0° |
| S1P | C1' | C2' | 122.5° | 120.0° |
| O1' | C1' | C2' | 119.6° | 120.0° |
| C1' | C2' | C3' | 122.3° | 109.5° |
| C1' | C2' | H2'1 | 107.6° | 109.5° |
| C1' | C2' | H2'2 | 107.7° | 109.5° |
| C3' | C2' | H2'1 | 107.6° | 109.5° |
| C3' | C2' | H2'2 | 107.6° | 109.5° |
| C2' | C3' | C4' | 124.1° | 109.5° |
| C2' | C3' | H3'1 | 107.0° | 109.5° |
| C2' | C3' | H3'2 | 107.0° | 109.5° |
| H2'1 | C2' | H2'2 | 102.2° | 109.4° |
| C4' | C3' | H3'1 | 107.0° | 109.5° |
| C4' | C3' | H3'2 | 107.0° | 109.4° |
| C3' | C4' | C5' | 125.0° | 109.5° |
| C3' | C4' | H4'1 | 106.8° | 109.5° |
| C3' | C4' | H4'2 | 106.7° | 109.4° |
| H3'1 | C3' | H3'2 | 102.6° | 109.5° |
| C5' | C4' | H4'1 | 106.7° | 109.5° |
| C5' | C4' | H4'2 | 106.7° | 109.5° |
| C4' | C5' | C6' | 124.3° | 109.5° |
| C4' | C5' | H5'1 | 106.9° | 109.5° |
| C4' | C5' | H5'2 | 107.0° | 109.5° |
| H4'1 | C4' | H4'2 | 102.9° | 109.5° |
| C6' | C5' | H5'1 | 107.0° | 109.4° |
| C6' | C5' | H5'2 | 107.0° | 109.5° |
| C5' | C6' | C7' | 125.0° | 109.5° |
| C5' | C6' | H6'1 | 106.7° | 109.4° |
| C5' | C6' | H6'2 | 106.7° | 109.5° |
| H5'1 | C5' | H5'2 | 102.7° | 109.5° |
| C7' | C6' | H6'1 | 106.7° | 109.4° |
| C7' | C6' | H6'2 | 106.8° | 109.5° |
| C6' | C7' | C8' | 111.4° | 109.5° |
| C6' | C7' | H7'1 | 111.5° | 109.4° |
| C6' | C7' | H7'2 | 111.5° | 109.5° |
| H6'1 | C6' | H6'2 | 102.9° | 109.4° |
| C8' | C7' | H7'1 | 111.5° | 109.4° |
| C8' | C7' | H7'2 | 111.5° | 109.5° |
| C7' | C8' | H8'1 | 111.4° | 109.5° |
| C7' | C8' | H8'2 | 111.5° | 109.5° |
| C7' | C8' | H8'3 | 111.5° | 109.4° |
| H7'1 | C7' | H7'2 | 98.9° | 109.5° |
| H8'1 | C8' | H8'2 | 111.5° | 109.5° |
| H8'1 | C8' | H8'3 | 111.4° | 109.5° |
| H8'2 | C8' | H8'3 | 98.9° | 109.5° |
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 | 0.0° | 0.3° |
| C2A | N1A | C6A | C5A | 0.0° | 0.0° |
| C2A | N1A | C6A | N6A | 179.8° | 180.0° |
| C6A | N1A | C2A | N3A | 0.1° | 0.0° |
| C6A | N1A | C2A | H2A | 179.9° | 180.0° |
| N1A | C6A | C5A | C4A | 0.1° | 0.3° |
| N1A | C6A | C5A | N6A | 179.8° | 180.0° |
| N1A | C6A | C5A | N7A | 180.0° | 180.0° |
| N1A | C6A | N6A | H61A | 180.0° | 0.0° |
| N1A | C6A | N6A | H62A | 54.7° | 180.0° |
| C2A | N3A | C4A | C5A | 0.2° | 0.5° |
| C2A | N3A | C4A | N9A | 179.9° | 179.6° |
| H2A | C2A | N3A | C4A | 180.0° | 179.7° |
| N3A | C4A | C5A | N9A | 179.9° | 179.3° |
| N3A | C4A | C5A | C6A | 0.2° | 0.5° |
| N3A | C4A | C5A | N7A | 179.9° | 179.7° |
| N3A | C4A | N9A | C8A | 179.8° | 179.5° |
| N3A | C4A | N9A | C1B | 2.2° | 0.8° |
| C4A | C5A | C6A | N7A | 179.8° | 179.7° |
| C4A | C5A | C6A | N6A | 179.7° | 179.7° |
| C4A | C5A | N7A | C8A | 0.1° | 0.2° |
| C5A | C4A | N9A | C8A | 0.1° | 0.4° |
| C5A | C4A | N9A | C1B | 177.9° | 179.9° |
| N9A | C4A | C5A | C6A | 179.8° | 179.8° |
| N9A | C4A | C5A | N7A | 0.0° | 0.4° |
| C4A | N9A | C8A | N7A | 0.2° | 0.3° |
| C4A | N9A | C8A | C1B | 178.0° | 179.7° |
| C4A | N9A | C8A | H8A | 179.8° | 179.8° |
| C4A | N9A | C1B | C2B | 105.1° | 94.1° |
| C4A | N9A | C1B | O4B | 141.4° | 151.7° |
| C4A | N9A | C1B | H1B | 19.2° | 28.8° |
| C5A | C6A | N6A | H61A | 0.2° | 180.0° |
| C5A | C6A | N6A | H62A | 125.1° | 0.0° |
| C6A | C5A | N7A | C8A | 179.9° | 180.0° |
| N7A | C5A | C6A | N6A | 0.2° | 0.0° |
| C5A | N7A | C8A | N9A | 0.2° | 0.0° |
| C5A | N7A | C8A | H8A | 179.8° | 180.0° |
| C6A | N6A | H61A | H62A | 125.4° | 179.9° |
| N7A | C8A | N9A | H8A | 180.0° | 179.9° |
| N7A | C8A | N9A | C1B | 177.8° | 180.0° |
| C8A | N9A | C1B | C2B | 77.3° | 85.6° |
| C8A | N9A | C1B | O4B | 36.1° | 28.6° |
| C8A | N9A | C1B | H1B | 158.4° | 151.5° |
| H8A | C8A | N9A | C1B | 2.2° | 0.1° |
| N9A | C1B | C2B | O4B | 119.4° | 118.6° |
| N9A | C1B | C2B | H1B | 118.9° | 122.9° |
| N9A | C1B | O4B | H1B | 119.1° | 122.8° |
| N9A | C1B | C2B | O2B | 81.4° | 86.2° |
| N9A | C1B | C2B | C3B | 160.9° | 155.7° |
| N9A | C1B | C2B | H2B | 37.4° | 37.4° |
| N9A | C1B | O4B | C4B | 144.1° | 158.7° |
| C2B | C1B | O4B | H1B | 124.0° | 118.5° |
| C1B | C2B | O2B | C3B | 112.5° | 112.6° |
| C1B | C2B | O2B | H2B | 123.5° | 123.6° |
| C1B | C2B | C3B | H2B | 122.9° | 118.2° |
| C1B | C2B | O2B | HO2A | 180.0° | 61.5° |
| C1B | C2B | C3B | O3B | 75.5° | 98.0° |
| C1B | C2B | C3B | C4B | 38.2° | 21.0° |
| C1B | C2B | C3B | H3B | 163.6° | 139.6° |
| C2B | C1B | O4B | C4B | 27.1° | 40.1° |
| O4B | C1B | C2B | O2B | 159.1° | 155.2° |
| O4B | C1B | C2B | C3B | 41.4° | 37.1° |
| O4B | C1B | C2B | H2B | 82.1° | 81.2° |
| C1B | O4B | C4B | C3B | 2.2° | 26.4° |
| C1B | O4B | C4B | C5B | 123.4° | 145.9° |
| C1B | O4B | C4B | H4B | 117.6° | 93.1° |
| H1B | C1B | C2B | O2B | 37.4° | 36.7° |
| H1B | C1B | C2B | C3B | 80.3° | 81.4° |
| H1B | C1B | C2B | H2B | 156.2° | 160.3° |
| H1B | C1B | O4B | C4B | 96.8° | 78.4° |
| O2B | C2B | C3B | H2B | 118.8° | 123.7° |
| O2B | C2B | C3B | O3B | 42.9° | 20.2° |
| O2B | C2B | C3B | C4B | 156.5° | 139.2° |
| O2B | C2B | C3B | H3B | 78.0° | 102.2° |
| C3B | C2B | O2B | HO2A | 67.5° | 174.2° |
| C2B | C3B | O3B | C4B | 107.7° | 114.8° |
| C2B | C3B | O3B | H3B | 125.6° | 122.5° |
| C2B | C3B | C4B | H3B | 124.0° | 118.6° |
| C2B | C3B | O3B | P3B | 112.9° | 121.4° |
| C2B | C3B | C4B | O4B | 23.3° | 1.9° |
| C2B | C3B | C4B | C5B | 98.0° | 121.4° |
| C2B | C3B | C4B | H4B | 142.9° | 117.6° |
| H2B | C2B | O2B | HO2A | 56.5° | 62.1° |
| H2B | C2B | C3B | O3B | 161.7° | 143.9° |
| H2B | C2B | C3B | C4B | 84.7° | 97.2° |
| H2B | C2B | C3B | H3B | 40.8° | 21.4° |
| O3B | C3B | C4B | H3B | 120.6° | 122.7° |
| C3B | O3B | P3B | O7A | 94.0° | 60.0° |
| C3B | O3B | P3B | O8A | 27.5° | 180.0° |
| C3B | O3B | P3B | O9A | 147.8° | 60.0° |
| O3B | C3B | C4B | O4B | 92.0° | 120.6° |
| O3B | C3B | C4B | C5B | 146.6° | 119.9° |
| O3B | C3B | C4B | H4B | 27.5° | 1.1° |
| C4B | C3B | O3B | P3B | 139.3° | 123.8° |
| C3B | C4B | O4B | C5B | 121.2° | 119.5° |
| C3B | C4B | O4B | H4B | 119.8° | 119.5° |
| C3B | C4B | C5B | H4B | 119.8° | 121.0° |
| C3B | C4B | C5B | O5B | 65.6° | 179.7° |
| C3B | C4B | C5B | H51A | 169.2° | 59.6° |
| C3B | C4B | C5B | H52A | 59.7° | 60.3° |
| H3B | C3B | O3B | P3B | 12.7° | 1.1° |
| H3B | C3B | C4B | O4B | 147.4° | 116.7° |
| H3B | C3B | C4B | C5B | 26.0° | 2.8° |
| H3B | C3B | C4B | H4B | 93.1° | 123.8° |
| O3B | P3B | O7A | O8A | 121.2° | 120.0° |
| O3B | P3B | O7A | O9A | 118.0° | 120.0° |
| O3B | P3B | O8A | O9A | 119.5° | 120.1° |
| O3B | P3B | O8A | HOA8 | 179.9° | 180.0° |
| O3B | P3B | O9A | HOA9 | 180.0° | 60.0° |
| O7A | P3B | O8A | O9A | 120.3° | 120.0° |
| O7A | P3B | O8A | HOA8 | 59.8° | 60.0° |
| O7A | P3B | O9A | HOA9 | 62.0° | 180.0° |
| O8A | P3B | O9A | HOA9 | 59.5° | 60.0° |
| O9A | P3B | O8A | HOA8 | 60.5° | 60.0° |
| O4B | C4B | C5B | H4B | 119.6° | 121.0° |
| O4B | C4B | C5B | O5B | 55.1° | 61.8° |
| O4B | C4B | C5B | H51A | 70.1° | 58.3° |
| O4B | C4B | C5B | H52A | 179.7° | 178.3° |
| C4B | C5B | O5B | H51A | 125.2° | 120.0° |
| C4B | C5B | O5B | H52A | 125.2° | 119.9° |
| C4B | C5B | H51A | H52A | 116.8° | 119.9° |
| C4B | C5B | O5B | P1A | 136.2° | 180.0° |
| H4B | C4B | C5B | O5B | 174.6° | 59.3° |
| H4B | C4B | C5B | H51A | 49.4° | 179.4° |
| H4B | C4B | C5B | H52A | 60.1° | 60.7° |
| O5B | C5B | H51A | H52A | 116.8° | 120.0° |
| C5B | O5B | P1A | O1A | 26.4° | 60.0° |
| C5B | O5B | P1A | O2A | 147.2° | 60.0° |
| C5B | O5B | P1A | O3A | 92.6° | 180.0° |
| H51A | C5B | O5B | P1A | 98.5° | 60.0° |
| H52A | C5B | O5B | P1A | 11.0° | 60.1° |
| O5B | P1A | O1A | O2A | 120.1° | 120.0° |
| O5B | P1A | O1A | O3A | 118.9° | 120.0° |
| O5B | P1A | O2A | O3A | 118.9° | 120.1° |
| O5B | P1A | O2A | HOA2 | 180.0° | 60.0° |
| O5B | P1A | O3A | P2A | 155.9° | 180.0° |
| O1A | P1A | O2A | O3A | 119.8° | 119.9° |
| O1A | P1A | O2A | HOA2 | 58.7° | 180.0° |
| O1A | P1A | O3A | P2A | 83.7° | 60.0° |
| O2A | P1A | O3A | P2A | 36.8° | 59.9° |
| O3A | P1A | O2A | HOA2 | 61.1° | 60.1° |
| P1A | O3A | P2A | O4A | 165.5° | 60.0° |
| P1A | O3A | P2A | O5A | 45.1° | 60.0° |
| P1A | O3A | P2A | O6A | 74.8° | 180.0° |
| O3A | P2A | O4A | O5A | 120.3° | 120.0° |
| O3A | P2A | O4A | O6A | 119.1° | 120.0° |
| O3A | P2A | O5A | O6A | 119.4° | 120.0° |
| O3A | P2A | O5A | HOA5 | 179.9° | 60.0° |
| O3A | P2A | O6A | CCP | 66.0° | 180.0° |
| O4A | P2A | O5A | O6A | 120.6° | 120.0° |
| O4A | P2A | O5A | HOA5 | 60.1° | 180.0° |
| O4A | P2A | O6A | CCP | 53.4° | 59.9° |
| O5A | P2A | O6A | CCP | 174.1° | 60.0° |
| O6A | P2A | O5A | HOA5 | 60.6° | 60.0° |
| P2A | O6A | CCP | CBP | 157.6° | 180.0° |
| P2A | O6A | CCP | H121 | 32.3° | 60.1° |
| P2A | O6A | CCP | H122 | 77.2° | 59.9° |
| O6A | CCP | CBP | H121 | 125.3° | 120.0° |
| O6A | CCP | CBP | H122 | 125.2° | 120.1° |
| O6A | CCP | CBP | CDP | 71.5° | 60.0° |
| O6A | CCP | CBP | CEP | 169.5° | 60.0° |
| O6A | CCP | CBP | CAP | 48.9° | 180.0° |
| O6A | CCP | H121 | H122 | 116.4° | 120.0° |
| CCP | CBP | CDP | CEP | 118.5° | 120.1° |
| CCP | CBP | CDP | CAP | 118.7° | 120.0° |
| CCP | CBP | CEP | CAP | 119.2° | 120.0° |
| CBP | CCP | H121 | H122 | 116.3° | 120.0° |
| CCP | CBP | CDP | H131 | 180.0° | 67.4° |
| CCP | CBP | CDP | H132 | 54.8° | 172.7° |
| CCP | CBP | CDP | H133 | 54.7° | 52.6° |
| CCP | CBP | CEP | H141 | 180.0° | 60.0° |
| CCP | CBP | CEP | H142 | 54.8° | 60.0° |
| CCP | CBP | CEP | H143 | 54.8° | 180.0° |
| CCP | CBP | CAP | OAP | 57.0° | 55.1° |
| CCP | CBP | CAP | C9P | 177.0° | 175.1° |
| CCP | CBP | CAP | H10 | 64.9° | 64.9° |
| CDP | CBP | CEP | CAP | 123.1° | 120.0° |
| CDP | CBP | CCP | H121 | 163.2° | 180.0° |
| CDP | CBP | CCP | H122 | 53.8° | 60.0° |
| CBP | CDP | H131 | H132 | 125.3° | 120.0° |
| CBP | CDP | H131 | H133 | 125.3° | 120.0° |
| CBP | CDP | H132 | H133 | 118.8° | 120.0° |
| CDP | CBP | CEP | H141 | 62.3° | 180.0° |
| CDP | CBP | CEP | H142 | 172.5° | 60.0° |
| CDP | CBP | CEP | H143 | 62.9° | 60.0° |
| CDP | CBP | CAP | OAP | 175.2° | 175.1° |
| CDP | CBP | CAP | C9P | 64.8° | 65.0° |
| CDP | CBP | CAP | H10 | 53.3° | 55.1° |
| CEP | CBP | CCP | H121 | 44.2° | 60.0° |
| CEP | CBP | CCP | H122 | 65.3° | 179.9° |
| CEP | CBP | CDP | H131 | 61.5° | 172.5° |
| CEP | CBP | CDP | H132 | 63.7° | 52.6° |
| CEP | CBP | CDP | H133 | 173.2° | 67.5° |
| CBP | CEP | H141 | H142 | 125.3° | 119.9° |
| CBP | CEP | H141 | H143 | 125.2° | 120.0° |
| CBP | CEP | H142 | H143 | 118.4° | 120.0° |
| CEP | CBP | CAP | OAP | 62.5° | 65.0° |
| CEP | CBP | CAP | C9P | 57.5° | 55.0° |
| CEP | CBP | CAP | H10 | 175.6° | 175.0° |
| CAP | CBP | CCP | H121 | 76.4° | 60.0° |
| CAP | CBP | CCP | H122 | 174.1° | 59.9° |
| CAP | CBP | CDP | H131 | 61.3° | 52.6° |
| CAP | CBP | CDP | H132 | 173.5° | 67.4° |
| CAP | CBP | CDP | H133 | 64.0° | 172.6° |
| CAP | CBP | CEP | H141 | 60.8° | 60.0° |
| CAP | CBP | CEP | H142 | 64.5° | 180.0° |
| CAP | CBP | CEP | H143 | 174.0° | 60.0° |
| CBP | CAP | OAP | C9P | 126.1° | 120.0° |
| CBP | CAP | OAP | H10 | 115.3° | 120.0° |
| CBP | CAP | C9P | H10 | 115.0° | 120.0° |
| CBP | CAP | OAP | HO1 | 180.0° | 59.9° |
| CBP | CAP | C9P | O9P | 64.4° | 105.8° |
| CBP | CAP | C9P | N8P | 117.6° | 74.2° |
| H131 | CDP | H132 | H133 | 118.7° | 120.0° |
| H141 | CEP | H142 | H143 | 118.3° | 120.1° |
| OAP | CAP | C9P | H10 | 122.2° | 120.0° |
| OAP | CAP | C9P | O9P | 172.8° | 14.2° |
| OAP | CAP | C9P | N8P | 5.2° | 165.8° |
| C9P | CAP | OAP | HO1 | 53.9° | 60.0° |
| CAP | C9P | O9P | N8P | 177.9° | 180.0° |
| CAP | C9P | N8P | C7P | 176.6° | 179.1° |
| CAP | C9P | N8P | HN8 | 3.4° | 0.9° |
| H10 | CAP | OAP | HO1 | 64.7° | 179.9° |
| H10 | CAP | C9P | O9P | 50.6° | 134.2° |
| H10 | CAP | C9P | N8P | 127.4° | 45.8° |
| O9P | C9P | N8P | C7P | 1.4° | 0.9° |
| O9P | C9P | N8P | HN8 | 178.6° | 179.1° |
| C9P | N8P | C7P | HN8 | 180.0° | 180.0° |
| C9P | N8P | C7P | C6P | 67.6° | 180.0° |
| C9P | N8P | C7P | H71 | 57.7° | 60.0° |
| C9P | N8P | C7P | H72 | 167.1° | 59.9° |
| N8P | C7P | C6P | H71 | 125.3° | 120.0° |
| N8P | C7P | C6P | H72 | 125.3° | 120.0° |
| N8P | C7P | H71 | H72 | 117.1° | 119.9° |
| N8P | C7P | C6P | C5P | 174.2° | 180.0° |
| N8P | C7P | C6P | H61 | 60.5° | 60.0° |
| N8P | C7P | C6P | H62 | 49.0° | 59.9° |
| HN8 | N8P | C7P | C6P | 112.4° | 0.0° |
| HN8 | N8P | C7P | H71 | 122.3° | 120.1° |
| HN8 | N8P | C7P | H72 | 12.8° | 120.0° |
| C6P | C7P | H71 | H72 | 117.1° | 120.0° |
| C7P | C6P | C5P | H61 | 125.3° | 119.9° |
| C7P | C6P | C5P | H62 | 125.2° | 120.1° |
| C7P | C6P | H61 | H62 | 117.1° | 119.9° |
| C7P | C6P | C5P | O5P | 57.1° | 0.1° |
| C7P | C6P | C5P | N4P | 123.4° | 180.0° |
| H71 | C7P | C6P | C5P | 48.9° | 60.0° |
| H71 | C7P | C6P | H61 | 174.2° | 180.0° |
| H71 | C7P | C6P | H62 | 76.3° | 60.1° |
| H72 | C7P | C6P | C5P | 60.5° | 59.9° |
| H72 | C7P | C6P | H61 | 64.8° | 60.0° |
| H72 | C7P | C6P | H62 | 174.3° | 179.9° |
| C5P | C6P | H61 | H62 | 117.0° | 120.1° |
| C6P | C5P | O5P | N4P | 179.5° | 180.0° |
| C6P | C5P | N4P | C3P | 178.9° | 179.9° |
| C6P | C5P | N4P | HN4 | 1.1° | 0.0° |
| H61 | C6P | C5P | O5P | 177.6° | 120.0° |
| H61 | C6P | C5P | N4P | 1.9° | 60.0° |
| H62 | C6P | C5P | O5P | 68.2° | 120.0° |
| H62 | C6P | C5P | N4P | 111.4° | 60.0° |
| O5P | C5P | N4P | C3P | 0.6° | 0.0° |
| O5P | C5P | N4P | HN4 | 179.4° | 179.9° |
| C5P | N4P | C3P | HN4 | 180.0° | 179.9° |
| C5P | N4P | C3P | C2P | 123.6° | 180.0° |
| C5P | N4P | C3P | H31 | 111.1° | 59.9° |
| C5P | N4P | C3P | H32 | 1.7° | 60.0° |
| N4P | C3P | C2P | H31 | 125.3° | 120.1° |
| N4P | C3P | C2P | H32 | 125.3° | 120.0° |
| N4P | C3P | H31 | H32 | 117.4° | 120.0° |
| N4P | C3P | C2P | S1P | 161.7° | 179.9° |
| N4P | C3P | C2P | H21 | 36.5° | 60.0° |
| N4P | C3P | C2P | H22 | 73.0° | 60.0° |
| HN4 | N4P | C3P | C2P | 56.4° | 0.1° |
| HN4 | N4P | C3P | H31 | 68.9° | 120.0° |
| HN4 | N4P | C3P | H32 | 178.3° | 120.1° |
| C2P | C3P | H31 | H32 | 117.4° | 120.0° |
| C3P | C2P | S1P | H21 | 125.2° | 120.0° |
| C3P | C2P | S1P | H22 | 125.2° | 120.0° |
| C3P | C2P | H21 | H22 | 116.4° | 120.0° |
| C3P | C2P | S1P | C1' | 107.9° | 180.0° |
| H31 | C3P | C2P | S1P | 73.0° | 60.0° |
| H31 | C3P | C2P | H21 | 161.8° | 180.0° |
| H31 | C3P | C2P | H22 | 52.3° | 60.0° |
| H32 | C3P | C2P | S1P | 36.4° | 59.9° |
| H32 | C3P | C2P | H21 | 88.8° | 60.0° |
| H32 | C3P | C2P | H22 | 161.7° | 180.0° |
| S1P | C2P | H21 | H22 | 116.3° | 120.1° |
| C2P | S1P | C1' | O1' | 21.8° | 0.0° |
| C2P | S1P | C1' | C2' | 168.7° | 179.9° |
| H21 | C2P | S1P | C1' | 126.9° | 60.0° |
| H22 | C2P | S1P | C1' | 17.3° | 60.0° |
| S1P | C1' | O1' | C2' | 169.8° | 179.9° |
| S1P | C1' | C2' | C3' | 174.7° | 180.0° |
| S1P | C1' | C2' | H2'1 | 49.4° | 60.0° |
| S1P | C1' | C2' | H2'2 | 60.0° | 60.0° |
| O1' | C1' | C2' | C3' | 16.1° | 0.1° |
| O1' | C1' | C2' | H2'1 | 141.3° | 120.0° |
| O1' | C1' | C2' | H2'2 | 109.2° | 120.1° |
| C1' | C2' | C3' | H2'1 | 125.3° | 120.1° |
| C1' | C2' | C3' | H2'2 | 125.3° | 120.0° |
| C1' | C2' | H2'1 | H2'2 | 113.2° | 120.0° |
| C1' | C2' | C3' | C4' | 84.4° | 180.0° |
| C1' | C2' | C3' | H3'1 | 40.9° | 60.0° |
| C1' | C2' | C3' | H3'2 | 150.3° | 60.1° |
| C3' | C2' | H2'1 | H2'2 | 113.1° | 120.0° |
| C2' | C3' | C4' | H3'1 | 125.3° | 120.0° |
| C2' | C3' | C4' | H3'2 | 125.3° | 120.0° |
| C2' | C3' | H3'1 | H3'2 | 112.5° | 120.1° |
| C2' | C3' | C4' | C5' | 63.0° | 180.0° |
| C2' | C3' | C4' | H4'1 | 62.2° | 60.0° |
| C2' | C3' | C4' | H4'2 | 171.7° | 60.1° |
| H2'1 | C2' | C3' | C4' | 150.4° | 59.9° |
| H2'1 | C2' | C3' | H3'1 | 84.3° | 179.9° |
| H2'1 | C2' | C3' | H3'2 | 25.1° | 60.0° |
| H2'2 | C2' | C3' | C4' | 40.9° | 60.0° |
| H2'2 | C2' | C3' | H3'1 | 166.2° | 60.0° |
| H2'2 | C2' | C3' | H3'2 | 84.4° | 180.0° |
| C4' | C3' | H3'1 | H3'2 | 112.5° | 119.9° |
| C3' | C4' | C5' | H4'1 | 125.3° | 120.0° |
| C3' | C4' | C5' | H4'2 | 125.2° | 119.9° |
| C3' | C4' | H4'1 | H4'2 | 112.1° | 120.0° |
| C3' | C4' | C5' | C6' | 157.4° | 179.9° |
| C3' | C4' | C5' | H5'1 | 77.3° | 60.0° |
| C3' | C4' | C5' | H5'2 | 32.1° | 60.0° |
| H3'1 | C3' | C4' | C5' | 171.7° | 60.0° |
| H3'1 | C3' | C4' | H4'1 | 63.0° | 180.0° |
| H3'1 | C3' | C4' | H4'2 | 46.4° | 60.0° |
| H3'2 | C3' | C4' | C5' | 62.3° | 60.0° |
| H3'2 | C3' | C4' | H4'1 | 172.5° | 60.0° |
| H3'2 | C3' | C4' | H4'2 | 63.0° | 179.9° |
| C5' | C4' | H4'1 | H4'2 | 112.2° | 120.0° |
| C4' | C5' | C6' | H5'1 | 125.3° | 120.0° |
| C4' | C5' | C6' | H5'2 | 125.3° | 120.1° |
| C4' | C5' | H5'1 | H5'2 | 112.4° | 120.0° |
| C4' | C5' | C6' | C7' | 167.9° | 179.9° |
| C4' | C5' | C6' | H6'1 | 66.9° | 60.0° |
| C4' | C5' | C6' | H6'2 | 42.6° | 59.9° |
| H4'1 | C4' | C5' | C6' | 32.2° | 60.1° |
| H4'1 | C4' | C5' | H5'1 | 157.4° | 180.0° |
| H4'1 | C4' | C5' | H5'2 | 93.2° | 60.0° |
| H4'2 | C4' | C5' | C6' | 77.3° | 60.0° |
| H4'2 | C4' | C5' | H5'1 | 47.9° | 60.0° |
| H4'2 | C4' | C5' | H5'2 | 157.4° | 180.0° |
| C6' | C5' | H5'1 | H5'2 | 112.4° | 120.0° |
| C5' | C6' | C7' | H6'1 | 125.2° | 119.9° |
| C5' | C6' | C7' | H6'2 | 125.2° | 120.2° |
| C5' | C6' | H6'1 | H6'2 | 112.1° | 120.0° |
| C5' | C6' | C7' | C8' | 87.4° | 180.0° |
| C5' | C6' | C7' | H7'1 | 37.8° | 60.1° |
| C5' | C6' | C7' | H7'2 | 147.3° | 59.9° |
| H5'1 | C5' | C6' | C7' | 42.6° | 60.1° |
| H5'1 | C5' | C6' | H6'1 | 167.8° | 180.0° |
| H5'1 | C5' | C6' | H6'2 | 82.7° | 60.1° |
| H5'2 | C5' | C6' | C7' | 66.8° | 59.9° |
| H5'2 | C5' | C6' | H6'1 | 58.4° | 60.0° |
| H5'2 | C5' | C6' | H6'2 | 167.9° | 180.0° |
| C7' | C6' | H6'1 | H6'2 | 112.2° | 120.0° |
| C6' | C7' | C8' | H7'1 | 125.2° | 119.9° |
| C6' | C7' | C8' | H7'2 | 125.3° | 120.1° |
| C6' | C7' | H7'1 | H7'2 | 117.5° | 120.0° |
| C6' | C7' | C8' | H8'1 | 179.9° | 179.9° |
| C6' | C7' | C8' | H8'2 | 54.7° | 59.9° |
| C6' | C7' | C8' | H8'3 | 54.8° | 60.1° |
| H6'1 | C6' | C7' | C8' | 147.3° | 60.1° |
| H6'1 | C6' | C7' | H7'1 | 87.4° | 180.0° |
| H6'1 | C6' | C7' | H7'2 | 22.1° | 60.0° |
| H6'2 | C6' | C7' | C8' | 37.8° | 59.9° |
| H6'2 | C6' | C7' | H7'1 | 163.0° | 60.1° |
| H6'2 | C6' | C7' | H7'2 | 87.5° | 179.9° |
| C8' | C7' | H7'1 | H7'2 | 117.4° | 120.0° |
| C7' | C8' | H8'1 | H8'2 | 125.4° | 120.0° |
| C7' | C8' | H8'1 | H8'3 | 125.2° | 120.0° |
| C7' | C8' | H8'2 | H8'3 | 117.4° | 120.0° |
| H7'1 | C7' | C8' | H8'1 | 54.7° | 60.0° |
| H7'1 | C7' | C8' | H8'2 | 179.9° | 60.0° |
| H7'1 | C7' | C8' | H8'3 | 70.5° | 180.0° |
| H7'2 | C7' | C8' | H8'1 | 54.8° | 60.0° |
| H7'2 | C7' | C8' | H8'2 | 70.6° | 180.0° |
| H7'2 | C7' | C8' | H8'3 | 180.0° | 60.0° |
| H8'1 | C8' | H8'2 | H8'3 | 117.3° | 120.0° |
