CS8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAP | CAP | sing | 1.43Å | 1.44Å | |
| OAP | H10 | sing | 0.97Å | 0.95Å | |
| CAP | C9P | sing | 1.53Å | 1.53Å | |
| CAP | CBP | sing | 1.56Å | 1.56Å | |
| CAP | H1 | sing | 1.10Å | 1.10Å | |
| C9P | O9P | doub | 1.23Å | 1.25Å | |
| C9P | N8P | sing | 1.39Å | 1.38Å | |
| N8P | C7P | sing | 1.44Å | 1.43Å | |
| N8P | HN8 | sing | 1.02Å | 1.00Å | |
| C7P | C6P | sing | 1.52Å | 1.52Å | |
| C7P | H71 | sing | 1.10Å | 1.10Å | |
| C7P | H72 | sing | 1.10Å | 1.10Å | |
| C6P | C5P | sing | 1.52Å | 1.52Å | |
| C6P | H61 | sing | 1.10Å | 1.10Å | |
| C6P | H62 | sing | 1.10Å | 1.10Å | |
| C5P | O5P | doub | 1.23Å | 1.25Å | |
| C5P | N4P | sing | 1.39Å | 1.40Å | |
| N4P | C3P | sing | 1.44Å | 1.46Å | |
| N4P | HN4 | sing | 1.02Å | 1.00Å | |
| C3P | C2P | sing | 1.52Å | 1.50Å | |
| C3P | H31 | sing | 1.09Å | 1.10Å | |
| C3P | H32 | sing | 1.09Å | 1.10Å | |
| C2P | S1P | sing | 1.82Å | 1.82Å | |
| C2P | H21 | sing | 1.09Å | 1.10Å | |
| C2P | H22 | sing | 1.09Å | 1.10Å | |
| S1P | C1' | sing | 1.77Å | 1.77Å | |
| C1' | O1' | doub | 1.22Å | 1.22Å | |
| C1' | C2' | sing | 1.51Å | 1.51Å | |
| C2' | S3' | sing | 1.81Å | 1.79Å | |
| C2' | H2'1 | sing | 1.10Å | 1.10Å | |
| C2' | H2'2 | sing | 1.09Å | 1.10Å | |
| C4' | S3' | sing | 1.81Å | 1.81Å | |
| C4' | C5' | sing | 1.53Å | 1.53Å | |
| C4' | H4'1 | sing | 1.09Å | 1.10Å | |
| C4' | H4'2 | sing | 1.10Å | 1.10Å | |
| C5' | C6' | sing | 1.53Å | 1.53Å | |
| C5' | H5'1 | sing | 1.10Å | 1.10Å | |
| C5' | H5'2 | sing | 1.10Å | 1.10Å | |
| C6' | C7' | sing | 1.53Å | 1.52Å | |
| C6' | H6'1 | sing | 1.10Å | 1.10Å | |
| C6' | H6'2 | sing | 1.10Å | 1.10Å | |
| C7' | C8' | sing | 1.52Å | 1.52Å | |
| C7' | H7'1 | sing | 1.10Å | 1.10Å | |
| C7' | H7'2 | sing | 1.10Å | 1.10Å | |
| C8' | H8'1 | sing | 1.10Å | 1.10Å | |
| C8' | H8'2 | sing | 1.09Å | 1.10Å | |
| C8' | H8'3 | sing | 1.09Å | 1.10Å | |
| CBP | CDP | sing | 1.55Å | 1.54Å | |
| CBP | CEP | sing | 1.54Å | 1.53Å | |
| CBP | CCP | sing | 1.55Å | 1.52Å | |
| CDP | H131 | sing | 1.10Å | 1.10Å | |
| CDP | H132 | sing | 1.10Å | 1.10Å | |
| CDP | H133 | sing | 1.10Å | 1.10Å | |
| CEP | H141 | sing | 1.10Å | 1.10Å | |
| CEP | H142 | sing | 1.10Å | 1.10Å | |
| CEP | H143 | sing | 1.10Å | 1.10Å | |
| CCP | O6A | sing | 1.42Å | 1.42Å | |
| CCP | H121 | sing | 1.10Å | 1.10Å | |
| CCP | H122 | sing | 1.09Å | 1.10Å | |
| O6A | P2A | sing | 1.61Å | 1.59Å | |
| P2A | O4A | doub | 1.50Å | 1.49Å | |
| P2A | O5A | sing | 1.62Å | 1.48Å | |
| P2A | O3A | sing | 1.62Å | 1.62Å | |
| O5A | HO5 | sing | 0.98Å | 0.95Å | |
| O3A | P1A | sing | 1.62Å | 1.60Å | |
| P1A | O1A | doub | 1.50Å | 1.48Å | |
| P1A | O2A | sing | 1.62Å | 1.50Å | |
| P1A | O5B | sing | 1.62Å | 1.60Å | |
| O2A | HO2 | sing | 0.98Å | 0.95Å | |
| O5B | C5B | sing | 1.42Å | 1.42Å | |
| C5B | C4B | sing | 1.52Å | 1.51Å | |
| C5B | H11 | sing | 1.09Å | 1.10Å | |
| C5B | H12 | sing | 1.09Å | 1.10Å | |
| C4B | O4B | sing | 1.44Å | 1.48Å | |
| C4B | C3B | sing | 1.52Å | 1.53Å | |
| C4B | H4' | sing | 1.10Å | 1.10Å | |
| O4B | C1B | sing | 1.44Å | 1.42Å | |
| C1B | N9A | sing | 1.46Å | 1.47Å | |
| C1B | C2B | sing | 1.53Å | 1.54Å | |
| C1B | H1' | sing | 1.10Å | 1.10Å | |
| N9A | C8A | sing | 1.37Å | 1.38Å | Aromatic |
| N9A | C4A | sing | 1.37Å | 1.38Å | Aromatic |
| C8A | N7A | doub | 1.32Å | 1.32Å | Aromatic |
| C8A | H8 | sing | 1.08Å | 1.08Å | |
| N7A | C5A | sing | 1.37Å | 1.39Å | Aromatic |
| C5A | C6A | doub | 1.39Å | 1.43Å | Aromatic |
| C5A | C4A | sing | 1.39Å | 1.39Å | Aromatic |
| C6A | N1A | sing | 1.35Å | 1.37Å | Aromatic |
| C6A | N6A | sing | 1.40Å | 1.34Å | |
| N1A | C2A | doub | 1.35Å | 1.35Å | Aromatic |
| C2A | N3A | sing | 1.35Å | 1.35Å | Aromatic |
| C2A | H2 | sing | 1.08Å | 1.08Å | |
| N3A | C4A | doub | 1.34Å | 1.36Å | Aromatic |
| N6A | HN61 | sing | 1.00Å | 1.00Å | |
| N6A | HN62 | sing | 1.00Å | 1.00Å | |
| C2B | O2B | sing | 1.43Å | 1.42Å | |
| C2B | C3B | sing | 1.52Å | 1.52Å | |
| C2B | H2' | sing | 1.09Å | 1.10Å | |
| O2B | H3 | sing | 0.97Å | 0.95Å | |
| C3B | O3B | sing | 1.41Å | 1.41Å | |
| C3B | H3' | sing | 1.10Å | 1.10Å | |
| O3B | P3B | sing | 1.61Å | 1.60Å | |
| P3B | O7A | doub | 1.50Å | 1.49Å | |
| P3B | O8A | sing | 1.62Å | 1.50Å | |
| P3B | O9A | sing | 1.62Å | 1.50Å | |
| O8A | HO8 | sing | 0.98Å | 0.95Å | |
| O9A | HO9 | sing | 0.98Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAP | OAP | H10 | 109.5° | 106.6° |
| OAP | CAP | C9P | 106.8° | 106.5° |
| OAP | CAP | CBP | 108.8° | 109.6° |
| OAP | CAP | H1 | 114.3° | 107.1° |
| C9P | CAP | CBP | 116.3° | 114.3° |
| C9P | CAP | H1 | 106.5° | 109.2° |
| CAP | C9P | O9P | 117.1° | 122.3° |
| CAP | C9P | N8P | 122.5° | 112.8° |
| CBP | CAP | H1 | 104.4° | 109.8° |
| CAP | CBP | CDP | 111.6° | 108.5° |
| CAP | CBP | CEP | 111.3° | 111.1° |
| CAP | CBP | CCP | 109.4° | 111.1° |
| O9P | C9P | N8P | 120.5° | 124.9° |
| C9P | N8P | C7P | 117.2° | 123.0° |
| C9P | N8P | HN8 | 121.4° | 119.4° |
| C7P | N8P | HN8 | 121.4° | 117.5° |
| N8P | C7P | C6P | 108.3° | 109.8° |
| N8P | C7P | H71 | 109.9° | 109.3° |
| N8P | C7P | H72 | 110.1° | 109.3° |
| C6P | C7P | H71 | 109.8° | 110.6° |
| C6P | C7P | H72 | 110.1° | 110.6° |
| C7P | C6P | C5P | 113.5° | 112.5° |
| C7P | C6P | H61 | 108.2° | 110.0° |
| C7P | C6P | H62 | 107.2° | 110.0° |
| H71 | C7P | H72 | 108.6° | 107.3° |
| C5P | C6P | H61 | 108.2° | 108.4° |
| C5P | C6P | H62 | 107.2° | 108.4° |
| C6P | C5P | O5P | 117.4° | 123.2° |
| C6P | C5P | N4P | 115.1° | 111.6° |
| H61 | C6P | H62 | 112.7° | 107.5° |
| O5P | C5P | N4P | 127.5° | 125.2° |
| C5P | N4P | C3P | 111.2° | 122.9° |
| C5P | N4P | HN4 | 124.4° | 118.6° |
| C3P | N4P | HN4 | 124.4° | 118.5° |
| N4P | C3P | C2P | 113.3° | 113.0° |
| N4P | C3P | H31 | 108.2° | 106.5° |
| N4P | C3P | H32 | 107.4° | 108.0° |
| C2P | C3P | H31 | 108.2° | 109.4° |
| C2P | C3P | H32 | 107.4° | 111.9° |
| C3P | C2P | S1P | 114.1° | 112.2° |
| C3P | C2P | H21 | 108.0° | 110.9° |
| C3P | C2P | H22 | 106.9° | 109.5° |
| H31 | C3P | H32 | 112.5° | 107.8° |
| S1P | C2P | H21 | 108.0° | 108.5° |
| S1P | C2P | H22 | 106.9° | 107.6° |
| C2P | S1P | C1' | 103.2° | 100.1° |
| H21 | C2P | H22 | 113.1° | 108.1° |
| S1P | C1' | O1' | 112.6° | 122.5° |
| S1P | C1' | C2' | 123.7° | 112.1° |
| O1' | C1' | C2' | 123.7° | 125.4° |
| C1' | C2' | S3' | 114.3° | 111.4° |
| C1' | C2' | H2'1 | 107.9° | 109.6° |
| C1' | C2' | H2'2 | 106.8° | 109.6° |
| S3' | C2' | H2'1 | 107.9° | 108.3° |
| S3' | C2' | H2'2 | 106.8° | 108.4° |
| C2' | S3' | C4' | 101.2° | 98.5° |
| H2'1 | C2' | H2'2 | 113.3° | 109.5° |
| S3' | C4' | C5' | 114.0° | 110.7° |
| S3' | C4' | H4'1 | 108.0° | 108.5° |
| S3' | C4' | H4'2 | 107.0° | 108.3° |
| C5' | C4' | H4'1 | 108.0° | 110.7° |
| C5' | C4' | H4'2 | 107.0° | 110.6° |
| C4' | C5' | C6' | 111.9° | 110.9° |
| C4' | C5' | H5'1 | 108.6° | 110.1° |
| C4' | C5' | H5'2 | 108.1° | 110.1° |
| H4'1 | C4' | H4'2 | 113.1° | 108.0° |
| C6' | C5' | H5'1 | 108.7° | 109.2° |
| C6' | C5' | H5'2 | 108.1° | 109.1° |
| C5' | C6' | C7' | 112.7° | 111.4° |
| C5' | C6' | H6'1 | 108.4° | 109.6° |
| C5' | C6' | H6'2 | 107.7° | 109.6° |
| H5'1 | C5' | H5'2 | 111.4° | 107.4° |
| C7' | C6' | H6'1 | 108.4° | 109.5° |
| C7' | C6' | H6'2 | 107.7° | 109.5° |
| C6' | C7' | C8' | 110.3° | 111.5° |
| C6' | C7' | H7'1 | 109.2° | 109.9° |
| C6' | C7' | H7'2 | 109.0° | 109.8° |
| H6'1 | C6' | H6'2 | 112.0° | 107.1° |
| C8' | C7' | H7'1 | 109.2° | 109.2° |
| C8' | C7' | H7'2 | 109.0° | 109.2° |
| C7' | C8' | H8'1 | 109.5° | 111.0° |
| C7' | C8' | H8'2 | 109.5° | 111.0° |
| C7' | C8' | H8'3 | 109.5° | 110.3° |
| H7'1 | C7' | H7'2 | 110.1° | 107.1° |
| H8'1 | C8' | H8'2 | 109.5° | 108.3° |
| H8'1 | C8' | H8'3 | 109.4° | 108.1° |
| H8'2 | C8' | H8'3 | 109.5° | 108.1° |
| CDP | CBP | CEP | 108.8° | 107.5° |
| CDP | CBP | CCP | 107.6° | 108.8° |
| CBP | CDP | H131 | 109.5° | 110.9° |
| CBP | CDP | H132 | 109.5° | 111.6° |
| CBP | CDP | H133 | 109.4° | 111.5° |
| CEP | CBP | CCP | 108.1° | 109.8° |
| CBP | CEP | H141 | 109.5° | 111.6° |
| CBP | CEP | H142 | 109.5° | 111.1° |
| CBP | CEP | H143 | 109.5° | 111.7° |
| CBP | CCP | O6A | 121.3° | 111.0° |
| CBP | CCP | H121 | 105.7° | 111.0° |
| CBP | CCP | H122 | 102.9° | 111.1° |
| H131 | CDP | H132 | 109.5° | 107.4° |
| H131 | CDP | H133 | 109.5° | 107.8° |
| H132 | CDP | H133 | 109.5° | 107.4° |
| H141 | CEP | H142 | 109.5° | 107.2° |
| H141 | CEP | H143 | 109.4° | 107.0° |
| H142 | CEP | H143 | 109.5° | 108.1° |
| O6A | CCP | H121 | 105.7° | 107.4° |
| O6A | CCP | H122 | 102.9° | 107.8° |
| CCP | O6A | P2A | 119.9° | 118.2° |
| H121 | CCP | H122 | 119.3° | 108.3° |
| O6A | P2A | O4A | 108.3° | 116.2° |
| O6A | P2A | O5A | 107.9° | 104.4° |
| O6A | P2A | O3A | 117.2° | 100.9° |
| O4A | P2A | O5A | 102.0° | 115.0° |
| O4A | P2A | O3A | 108.3° | 115.1° |
| O5A | P2A | O3A | 112.1° | 103.4° |
| P2A | O5A | HO5 | 109.5° | 119.0° |
| P2A | O3A | P1A | 123.6° | 131.0° |
| O3A | P1A | O1A | 108.0° | 114.6° |
| O3A | P1A | O2A | 109.3° | 103.6° |
| O3A | P1A | O5B | 103.5° | 102.9° |
| O1A | P1A | O2A | 120.0° | 114.4° |
| O1A | P1A | O5B | 107.6° | 115.1° |
| O2A | P1A | O5B | 107.2° | 104.8° |
| P1A | O2A | HO2 | 109.5° | 118.9° |
| P1A | O5B | C5B | 120.4° | 120.0° |
| O5B | C5B | C4B | 110.7° | 109.0° |
| O5B | C5B | H11 | 109.0° | 108.8° |
| O5B | C5B | H12 | 108.8° | 108.8° |
| C4B | C5B | H11 | 109.1° | 110.5° |
| C4B | C5B | H12 | 108.8° | 110.5° |
| C5B | C4B | O4B | 111.6° | 109.8° |
| C5B | C4B | C3B | 111.1° | 113.5° |
| C5B | C4B | H4' | 106.0° | 108.7° |
| H11 | C5B | H12 | 110.4° | 109.1° |
| O4B | C4B | C3B | 106.6° | 105.2° |
| O4B | C4B | H4' | 110.5° | 108.3° |
| C4B | O4B | C1B | 109.2° | 108.4° |
| C3B | C4B | H4' | 111.0° | 111.3° |
| C4B | C3B | C2B | 104.1° | 102.3° |
| C4B | C3B | O3B | 113.5° | 112.1° |
| C4B | C3B | H3' | 111.7° | 110.2° |
| O4B | C1B | N9A | 114.3° | 109.5° |
| O4B | C1B | C2B | 106.6° | 107.6° |
| O4B | C1B | H1' | 107.9° | 108.2° |
| N9A | C1B | C2B | 108.5° | 113.6° |
| N9A | C1B | H1' | 106.0° | 105.2° |
| C1B | N9A | C8A | 132.7° | 126.1° |
| C1B | N9A | C4A | 121.8° | 126.9° |
| C2B | C1B | H1' | 113.8° | 112.6° |
| C1B | C2B | O2B | 111.0° | 109.2° |
| C1B | C2B | C3B | 102.4° | 102.8° |
| C1B | C2B | H2' | 115.2° | 114.1° |
| C8A | N9A | C4A | 105.4° | 106.9° |
| N9A | C8A | N7A | 113.9° | 112.2° |
| N9A | C8A | H8 | 123.0° | 122.2° |
| N9A | C4A | C5A | 106.2° | 105.3° |
| N9A | C4A | N3A | 127.1° | 127.5° |
| N7A | C8A | H8 | 123.1° | 125.5° |
| C8A | N7A | C5A | 104.0° | 104.8° |
| N7A | C5A | C6A | 133.1° | 132.4° |
| N7A | C5A | C4A | 110.4° | 110.7° |
| C6A | C5A | C4A | 116.5° | 116.9° |
| C5A | C6A | N1A | 117.9° | 119.1° |
| C5A | C6A | N6A | 123.3° | 120.7° |
| C5A | C4A | N3A | 126.7° | 127.2° |
| N1A | C6A | N6A | 118.8° | 120.2° |
| C6A | N1A | C2A | 118.9° | 117.5° |
| C6A | N6A | HN61 | 109.5° | 119.5° |
| C6A | N6A | HN62 | 109.5° | 119.4° |
| N1A | C2A | N3A | 128.4° | 128.8° |
| N1A | C2A | H2 | 115.8° | 115.5° |
| N3A | C2A | H2 | 115.8° | 115.6° |
| C2A | N3A | C4A | 111.5° | 110.5° |
| HN61 | N6A | HN62 | 109.5° | 120.8° |
| O2B | C2B | C3B | 114.9° | 111.2° |
| O2B | C2B | H2' | 102.6° | 106.9° |
| C2B | O2B | H3 | 109.5° | 107.3° |
| C3B | C2B | H2' | 111.2° | 112.6° |
| C2B | C3B | O3B | 112.9° | 113.5° |
| C2B | C3B | H3' | 112.3° | 109.5° |
| O3B | C3B | H3' | 102.7° | 109.0° |
| C3B | O3B | P3B | 141.2° | 118.1° |
| O3B | P3B | O7A | 107.3° | 115.1° |
| O3B | P3B | O8A | 106.3° | 103.8° |
| O3B | P3B | O9A | 107.2° | 102.6° |
| O7A | P3B | O8A | 111.7° | 115.3° |
| O7A | P3B | O9A | 112.6° | 115.0° |
| O8A | P3B | O9A | 111.5° | 103.3° |
| P3B | O8A | HO8 | 109.5° | 118.9° |
| P3B | O9A | HO9 | 109.5° | 118.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAP | CAP | C9P | CBP | 121.7° | 121.2° |
| OAP | CAP | C9P | H1 | 122.5° | 115.3° |
| OAP | CAP | CBP | H1 | 122.4° | 117.4° |
| OAP | CAP | C9P | O9P | 151.7° | 34.7° |
| OAP | CAP | C9P | N8P | 28.2° | 146.5° |
| OAP | CAP | CBP | CDP | 58.6° | 179.4° |
| OAP | CAP | CBP | CEP | 179.7° | 62.7° |
| OAP | CAP | CBP | CCP | 60.4° | 59.8° |
| H10 | OAP | CAP | C9P | 154.1° | 44.2° |
| H10 | OAP | CAP | CBP | 79.6° | 80.0° |
| H10 | OAP | CAP | H1 | 36.7° | 160.9° |
| C9P | CAP | CBP | H1 | 116.9° | 123.2° |
| CAP | C9P | O9P | N8P | 179.9° | 178.7° |
| CAP | C9P | N8P | C7P | 177.1° | 178.8° |
| CAP | C9P | N8P | HN8 | 2.9° | 0.6° |
| C9P | CAP | CBP | CDP | 62.1° | 60.0° |
| C9P | CAP | CBP | CEP | 59.6° | 177.9° |
| C9P | CAP | CBP | CCP | 179.0° | 59.6° |
| CBP | CAP | C9P | O9P | 86.6° | 86.5° |
| CBP | CAP | C9P | N8P | 93.5° | 92.3° |
| CAP | CBP | CDP | CEP | 123.1° | 120.2° |
| CAP | CBP | CDP | CCP | 120.0° | 121.0° |
| CAP | CBP | CEP | CCP | 120.1° | 123.3° |
| CAP | CBP | CDP | H131 | 163.9° | 55.9° |
| CAP | CBP | CDP | H132 | 43.9° | 175.6° |
| CAP | CBP | CDP | H133 | 76.1° | 64.3° |
| CAP | CBP | CEP | H141 | 79.6° | 171.7° |
| CAP | CBP | CEP | H142 | 160.4° | 52.2° |
| CAP | CBP | CEP | H143 | 40.4° | 68.6° |
| CAP | CBP | CCP | O6A | 92.9° | 180.0° |
| CAP | CBP | CCP | H121 | 27.1° | 60.6° |
| CAP | CBP | CCP | H122 | 153.0° | 60.0° |
| H1 | CAP | C9P | O9P | 29.2° | 150.0° |
| H1 | CAP | C9P | N8P | 150.7° | 31.2° |
| H1 | CAP | CBP | CDP | 179.0° | 63.2° |
| H1 | CAP | CBP | CEP | 57.3° | 54.7° |
| H1 | CAP | CBP | CCP | 62.0° | 177.3° |
| O9P | C9P | N8P | C7P | 3.0° | 0.0° |
| O9P | C9P | N8P | HN8 | 177.0° | 178.2° |
| C9P | N8P | C7P | HN8 | 180.0° | 178.2° |
| C9P | N8P | C7P | C6P | 121.7° | 90.0° |
| C9P | N8P | C7P | H71 | 118.3° | 148.5° |
| C9P | N8P | C7P | H72 | 1.3° | 31.4° |
| N8P | C7P | C6P | H71 | 120.0° | 120.7° |
| N8P | C7P | C6P | H72 | 120.5° | 120.7° |
| N8P | C7P | H71 | H72 | 120.5° | 118.4° |
| N8P | C7P | C6P | C5P | 148.9° | 60.7° |
| N8P | C7P | C6P | H61 | 28.9° | 60.2° |
| N8P | C7P | C6P | H62 | 92.9° | 178.5° |
| HN8 | N8P | C7P | C6P | 58.3° | 88.2° |
| HN8 | N8P | C7P | H71 | 61.7° | 33.2° |
| HN8 | N8P | C7P | H72 | 178.7° | 150.3° |
| C6P | C7P | H71 | H72 | 120.4° | 120.7° |
| C7P | C6P | C5P | H61 | 120.0° | 121.9° |
| C7P | C6P | C5P | H62 | 118.2° | 121.8° |
| C7P | C6P | H61 | H62 | 118.4° | 119.8° |
| C7P | C6P | C5P | O5P | 0.7° | 0.1° |
| C7P | C6P | C5P | N4P | 178.7° | 180.0° |
| H71 | C7P | C6P | C5P | 91.1° | 60.0° |
| H71 | C7P | C6P | H61 | 148.9° | 179.1° |
| H71 | C7P | C6P | H62 | 27.1° | 60.9° |
| H72 | C7P | C6P | C5P | 28.4° | 178.7° |
| H72 | C7P | C6P | H61 | 91.6° | 60.4° |
| H72 | C7P | C6P | H62 | 146.6° | 57.8° |
| C5P | C6P | H61 | H62 | 118.4° | 116.9° |
| C6P | C5P | O5P | N4P | 179.3° | 179.9° |
| C6P | C5P | N4P | C3P | 179.0° | 179.9° |
| C6P | C5P | N4P | HN4 | 1.0° | 0.1° |
| H61 | C6P | C5P | O5P | 119.3° | 121.8° |
| H61 | C6P | C5P | N4P | 61.3° | 58.2° |
| H62 | C6P | C5P | O5P | 119.0° | 121.9° |
| H62 | C6P | C5P | N4P | 60.4° | 58.2° |
| O5P | C5P | N4P | C3P | 0.3° | 0.0° |
| O5P | C5P | N4P | HN4 | 179.7° | 180.0° |
| C5P | N4P | C3P | HN4 | 180.0° | 180.0° |
| C5P | N4P | C3P | C2P | 159.2° | 90.0° |
| C5P | N4P | C3P | H31 | 80.8° | 30.1° |
| C5P | N4P | C3P | H32 | 40.9° | 145.6° |
| N4P | C3P | C2P | H31 | 120.0° | 118.5° |
| N4P | C3P | C2P | H32 | 118.4° | 122.2° |
| N4P | C3P | H31 | H32 | 118.4° | 115.7° |
| N4P | C3P | C2P | S1P | 156.6° | 178.5° |
| N4P | C3P | C2P | H21 | 36.6° | 60.0° |
| N4P | C3P | C2P | H22 | 85.4° | 59.1° |
| HN4 | N4P | C3P | C2P | 20.8° | 90.0° |
| HN4 | N4P | C3P | H31 | 99.2° | 149.9° |
| HN4 | N4P | C3P | H32 | 139.1° | 34.3° |
| C2P | C3P | H31 | H32 | 118.4° | 121.9° |
| C3P | C2P | S1P | H21 | 120.0° | 122.8° |
| C3P | C2P | S1P | H22 | 118.0° | 120.5° |
| C3P | C2P | H21 | H22 | 118.1° | 120.0° |
| C3P | C2P | S1P | C1' | 86.9° | 177.2° |
| H31 | C3P | C2P | S1P | 83.4° | 60.0° |
| H31 | C3P | C2P | H21 | 156.6° | 178.5° |
| H31 | C3P | C2P | H22 | 34.6° | 59.4° |
| H32 | C3P | C2P | S1P | 38.2° | 59.3° |
| H32 | C3P | C2P | H21 | 81.8° | 62.2° |
| H32 | C3P | C2P | H22 | 156.2° | 178.7° |
| S1P | C2P | H21 | H22 | 118.1° | 116.4° |
| C2P | S1P | C1' | O1' | 1.1° | 0.1° |
| C2P | S1P | C1' | C2' | 178.7° | 180.0° |
| H21 | C2P | S1P | C1' | 153.1° | 60.0° |
| H22 | C2P | S1P | C1' | 31.1° | 56.6° |
| S1P | C1' | O1' | C2' | 177.7° | 179.9° |
| S1P | C1' | C2' | S3' | 176.3° | 179.8° |
| S1P | C1' | C2' | H2'1 | 63.8° | 59.9° |
| S1P | C1' | C2' | H2'2 | 58.4° | 60.3° |
| O1' | C1' | C2' | S3' | 1.2° | 0.1° |
| O1' | C1' | C2' | H2'1 | 118.8° | 120.0° |
| O1' | C1' | C2' | H2'2 | 119.0° | 119.8° |
| C1' | C2' | S3' | H2'1 | 120.0° | 120.6° |
| C1' | C2' | S3' | H2'2 | 117.9° | 120.6° |
| C1' | C2' | H2'1 | H2'2 | 118.0° | 120.3° |
| C1' | C2' | S3' | C4' | 154.5° | 180.0° |
| S3' | C2' | H2'1 | H2'2 | 118.0° | 118.0° |
| C2' | S3' | C4' | C5' | 65.9° | 178.4° |
| C2' | S3' | C4' | H4'1 | 174.1° | 60.0° |
| C2' | S3' | C4' | H4'2 | 52.1° | 57.1° |
| H2'1 | C2' | S3' | C4' | 34.4° | 59.4° |
| H2'2 | C2' | S3' | C4' | 87.7° | 59.3° |
| S3' | C4' | C5' | H4'1 | 120.0° | 120.3° |
| S3' | C4' | C5' | H4'2 | 118.0° | 120.0° |
| S3' | C4' | H4'1 | H4'2 | 118.2° | 117.2° |
| S3' | C4' | C5' | C6' | 179.2° | 179.7° |
| S3' | C4' | C5' | H5'1 | 60.8° | 58.8° |
| S3' | C4' | C5' | H5'2 | 60.3° | 59.4° |
| C5' | C4' | H4'1 | H4'2 | 118.1° | 121.2° |
| C4' | C5' | C6' | H5'1 | 120.0° | 121.5° |
| C4' | C5' | C6' | H5'2 | 118.9° | 121.5° |
| C4' | C5' | H5'1 | H5'2 | 119.0° | 119.8° |
| C4' | C5' | C6' | C7' | 67.3° | 178.6° |
| C4' | C5' | C6' | H6'1 | 172.6° | 60.1° |
| C4' | C5' | C6' | H6'2 | 51.3° | 57.2° |
| H4'1 | C4' | C5' | C6' | 59.2° | 60.0° |
| H4'1 | C4' | C5' | H5'1 | 179.2° | 179.1° |
| H4'1 | C4' | C5' | H5'2 | 59.7° | 60.9° |
| H4'2 | C4' | C5' | C6' | 62.8° | 59.7° |
| H4'2 | C4' | C5' | H5'1 | 57.2° | 61.2° |
| H4'2 | C4' | C5' | H5'2 | 178.3° | 179.4° |
| C6' | C5' | H5'1 | H5'2 | 119.0° | 118.2° |
| C5' | C6' | C7' | H6'1 | 120.0° | 121.4° |
| C5' | C6' | C7' | H6'2 | 118.6° | 121.4° |
| C5' | C6' | H6'1 | H6'2 | 118.7° | 118.8° |
| C5' | C6' | C7' | C8' | 122.2° | 178.6° |
| C5' | C6' | C7' | H7'1 | 2.2° | 60.2° |
| C5' | C6' | C7' | H7'2 | 118.1° | 57.4° |
| H5'1 | C5' | C6' | C7' | 52.6° | 60.0° |
| H5'1 | C5' | C6' | H6'1 | 67.4° | 61.4° |
| H5'1 | C5' | C6' | H6'2 | 171.2° | 178.7° |
| H5'2 | C5' | C6' | C7' | 173.7° | 57.1° |
| H5'2 | C5' | C6' | H6'1 | 53.7° | 178.5° |
| H5'2 | C5' | C6' | H6'2 | 67.7° | 64.3° |
| C7' | C6' | H6'1 | H6'2 | 118.7° | 118.7° |
| C6' | C7' | C8' | H7'1 | 120.0° | 121.6° |
| C6' | C7' | C8' | H7'2 | 119.6° | 121.6° |
| C6' | C7' | H7'1 | H7'2 | 119.6° | 119.3° |
| C6' | C7' | C8' | H8'1 | 17.9° | 60.2° |
| C6' | C7' | C8' | H8'2 | 137.9° | 60.3° |
| C6' | C7' | C8' | H8'3 | 102.0° | 180.0° |
| H6'1 | C6' | C7' | C8' | 117.8° | 60.0° |
| H6'1 | C6' | C7' | H7'1 | 122.2° | 61.2° |
| H6'1 | C6' | C7' | H7'2 | 1.9° | 178.8° |
| H6'2 | C6' | C7' | C8' | 3.6° | 57.2° |
| H6'2 | C6' | C7' | H7'1 | 116.4° | 178.4° |
| H6'2 | C6' | C7' | H7'2 | 123.3° | 64.0° |
| C8' | C7' | H7'1 | H7'2 | 119.7° | 118.1° |
| C7' | C8' | H8'1 | H8'2 | 120.0° | 122.1° |
| C7' | C8' | H8'1 | H8'3 | 120.0° | 121.0° |
| C7' | C8' | H8'2 | H8'3 | 120.0° | 121.0° |
| H7'1 | C7' | C8' | H8'1 | 102.1° | 178.2° |
| H7'1 | C7' | C8' | H8'2 | 18.0° | 61.3° |
| H7'1 | C7' | C8' | H8'3 | 138.0° | 58.4° |
| H7'2 | C7' | C8' | H8'1 | 137.6° | 61.4° |
| H7'2 | C7' | C8' | H8'2 | 102.4° | 178.2° |
| H7'2 | C7' | C8' | H8'3 | 17.6° | 58.4° |
| H8'1 | C8' | H8'2 | H8'3 | 119.9° | 116.9° |
| CDP | CBP | CEP | CCP | 116.6° | 118.1° |
| CBP | CDP | H131 | H132 | 120.0° | 122.2° |
| CBP | CDP | H131 | H133 | 120.0° | 122.3° |
| CBP | CDP | H132 | H133 | 120.0° | 122.5° |
| CDP | CBP | CEP | H141 | 43.7° | 53.2° |
| CDP | CBP | CEP | H142 | 76.3° | 66.4° |
| CDP | CBP | CEP | H143 | 163.7° | 172.9° |
| CDP | CBP | CCP | O6A | 28.5° | 60.6° |
| CDP | CBP | CCP | H121 | 148.5° | 180.0° |
| CDP | CBP | CCP | H122 | 85.6° | 59.4° |
| CEP | CBP | CDP | H131 | 40.8° | 64.3° |
| CEP | CBP | CDP | H132 | 79.2° | 55.4° |
| CEP | CBP | CDP | H133 | 160.8° | 175.5° |
| CBP | CEP | H141 | H142 | 120.0° | 121.8° |
| CBP | CEP | H141 | H143 | 120.0° | 122.4° |
| CBP | CEP | H142 | H143 | 120.0° | 122.8° |
| CEP | CBP | CCP | O6A | 145.8° | 56.8° |
| CEP | CBP | CCP | H121 | 94.2° | 62.6° |
| CEP | CBP | CCP | H122 | 31.7° | 176.8° |
| CCP | CBP | CDP | H131 | 76.1° | 176.9° |
| CCP | CBP | CDP | H132 | 163.9° | 63.4° |
| CCP | CBP | CDP | H133 | 43.9° | 56.8° |
| CCP | CBP | CEP | H141 | 160.3° | 65.0° |
| CCP | CBP | CEP | H142 | 40.3° | 175.5° |
| CCP | CBP | CEP | H143 | 79.7° | 54.7° |
| CBP | CCP | O6A | H121 | 120.0° | 121.5° |
| CBP | CCP | O6A | H122 | 114.1° | 121.9° |
| CBP | CCP | H121 | H122 | 115.1° | 122.3° |
| CBP | CCP | O6A | P2A | 167.0° | 180.0° |
| H131 | CDP | H132 | H133 | 120.0° | 115.7° |
| H141 | CEP | H142 | H143 | 120.0° | 115.1° |
| O6A | CCP | H121 | H122 | 115.1° | 116.2° |
| CCP | O6A | P2A | O4A | 123.7° | 180.0° |
| CCP | O6A | P2A | O5A | 126.7° | 52.3° |
| CCP | O6A | P2A | O3A | 0.9° | 54.8° |
| H121 | CCP | O6A | P2A | 47.0° | 58.5° |
| H122 | CCP | O6A | P2A | 78.9° | 58.1° |
| O6A | P2A | O4A | O5A | 113.6° | 122.3° |
| O6A | P2A | O4A | O3A | 128.0° | 117.7° |
| O6A | P2A | O5A | O3A | 130.4° | 105.2° |
| O6A | P2A | O5A | HO5 | 90.3° | 177.1° |
| O6A | P2A | O3A | P1A | 111.6° | 174.0° |
| O4A | P2A | O5A | O3A | 115.7° | 126.3° |
| O4A | P2A | O5A | HO5 | 155.8° | 48.6° |
| O4A | P2A | O3A | P1A | 125.6° | 60.0° |
| O5A | P2A | O3A | P1A | 13.9° | 66.2° |
| O3A | P2A | O5A | HO5 | 40.1° | 77.7° |
| P2A | O3A | P1A | O1A | 65.9° | 60.0° |
| P2A | O3A | P1A | O2A | 66.2° | 174.7° |
| P2A | O3A | P1A | O5B | 179.9° | 65.8° |
| O3A | P1A | O1A | O2A | 126.1° | 119.5° |
| O3A | P1A | O1A | O5B | 111.2° | 119.1° |
| O3A | P1A | O2A | O5B | 111.6° | 107.6° |
| O3A | P1A | O2A | HO2 | 30.0° | 79.4° |
| O3A | P1A | O5B | C5B | 63.9° | 54.6° |
| O1A | P1A | O2A | O5B | 123.0° | 127.0° |
| O1A | P1A | O2A | HO2 | 95.4° | 46.1° |
| O1A | P1A | O5B | C5B | 50.3° | 180.0° |
| O2A | P1A | O5B | C5B | 179.4° | 53.5° |
| O5B | P1A | O2A | HO2 | 141.6° | 173.1° |
| P1A | O5B | C5B | C4B | 178.2° | 180.0° |
| P1A | O5B | C5B | H11 | 58.2° | 59.4° |
| P1A | O5B | C5B | H12 | 62.3° | 59.4° |
| O5B | C5B | C4B | H11 | 120.0° | 119.6° |
| O5B | C5B | C4B | H12 | 119.5° | 119.5° |
| O5B | C5B | H11 | H12 | 119.5° | 118.6° |
| O5B | C5B | C4B | O4B | 68.5° | 62.2° |
| O5B | C5B | C4B | C3B | 50.3° | 179.5° |
| O5B | C5B | C4B | H4' | 171.1° | 56.1° |
| C4B | C5B | H11 | H12 | 119.5° | 121.8° |
| C5B | C4B | O4B | C3B | 121.5° | 122.4° |
| C5B | C4B | O4B | H4' | 117.7° | 118.5° |
| C5B | C4B | C3B | H4' | 117.7° | 123.0° |
| C5B | C4B | O4B | C1B | 123.3° | 148.9° |
| C5B | C4B | C3B | C2B | 103.0° | 157.1° |
| C5B | C4B | C3B | O3B | 133.9° | 81.0° |
| C5B | C4B | C3B | H3' | 18.4° | 40.7° |
| H11 | C5B | C4B | O4B | 171.5° | 57.4° |
| H11 | C5B | C4B | C3B | 69.6° | 60.0° |
| H11 | C5B | C4B | H4' | 51.1° | 175.6° |
| H12 | C5B | C4B | O4B | 50.9° | 178.3° |
| H12 | C5B | C4B | C3B | 169.8° | 61.0° |
| H12 | C5B | C4B | H4' | 69.5° | 63.4° |
| O4B | C4B | C3B | H4' | 120.5° | 117.0° |
| C4B | O4B | C1B | N9A | 141.6° | 129.0° |
| C4B | O4B | C1B | C2B | 21.8° | 5.0° |
| C4B | O4B | C1B | H1' | 100.8° | 116.9° |
| O4B | C4B | C3B | C2B | 18.8° | 37.0° |
| O4B | C4B | C3B | O3B | 104.3° | 159.0° |
| O4B | C4B | C3B | H3' | 140.2° | 79.3° |
| C3B | C4B | O4B | C1B | 1.8° | 26.4° |
| C4B | C3B | C2B | C1B | 30.6° | 32.8° |
| C4B | C3B | C2B | O2B | 151.0° | 84.0° |
| C4B | C3B | C2B | O3B | 123.5° | 121.0° |
| C4B | C3B | C2B | H3' | 121.0° | 116.9° |
| C4B | C3B | C2B | H2' | 93.0° | 156.0° |
| C4B | C3B | O3B | H3' | 120.7° | 122.4° |
| C4B | C3B | O3B | P3B | 79.7° | 175.2° |
| H4' | C4B | O4B | C1B | 118.9° | 92.7° |
| H4' | C4B | C3B | C2B | 139.3° | 80.0° |
| H4' | C4B | C3B | O3B | 16.2° | 42.0° |
| H4' | C4B | C3B | H3' | 99.3° | 163.6° |
| O4B | C1B | N9A | C2B | 118.8° | 120.3° |
| O4B | C1B | N9A | H1' | 118.7° | 116.1° |
| O4B | C1B | C2B | H1' | 118.8° | 119.2° |
| O4B | C1B | N9A | C8A | 57.1° | 33.9° |
| O4B | C1B | N9A | C4A | 123.0° | 146.1° |
| O4B | C1B | C2B | O2B | 156.0° | 100.1° |
| O4B | C1B | C2B | C3B | 32.8° | 18.1° |
| O4B | C1B | C2B | H2' | 88.0° | 140.4° |
| N9A | C1B | C2B | H1' | 117.7° | 119.5° |
| C1B | N9A | C8A | C4A | 179.9° | 180.0° |
| C1B | N9A | C8A | N7A | 179.9° | 180.0° |
| C1B | N9A | C8A | H8 | 0.1° | 0.0° |
| C1B | N9A | C4A | C5A | 179.9° | 180.0° |
| C1B | N9A | C4A | N3A | 0.2° | 0.0° |
| N9A | C1B | C2B | O2B | 80.5° | 138.6° |
| N9A | C1B | C2B | C3B | 156.3° | 103.3° |
| N9A | C1B | C2B | H2' | 35.5° | 19.0° |
| C2B | C1B | N9A | C8A | 61.7° | 86.4° |
| C2B | C1B | N9A | C4A | 118.3° | 93.6° |
| C1B | C2B | O2B | C3B | 115.5° | 112.8° |
| C1B | C2B | O2B | H2' | 123.6° | 123.9° |
| C1B | C2B | C3B | H2' | 123.5° | 123.2° |
| C1B | C2B | O2B | H3 | 71.8° | 172.9° |
| C1B | C2B | C3B | O3B | 92.9° | 153.8° |
| C1B | C2B | C3B | H3' | 151.5° | 84.1° |
| H1' | C1B | N9A | C8A | 175.8° | 150.0° |
| H1' | C1B | N9A | C4A | 4.3° | 30.0° |
| H1' | C1B | C2B | O2B | 37.2° | 19.1° |
| H1' | C1B | C2B | C3B | 85.9° | 137.3° |
| H1' | C1B | C2B | H2' | 153.3° | 100.4° |
| N9A | C8A | N7A | H8 | 180.0° | 180.0° |
| N9A | C8A | N7A | C5A | 0.1° | 0.0° |
| C8A | N9A | C4A | C5A | 0.1° | 0.0° |
| C8A | N9A | C4A | N3A | 179.9° | 180.0° |
| C4A | N9A | C8A | N7A | 0.1° | 0.0° |
| C4A | N9A | C8A | H8 | 179.9° | 180.0° |
| N9A | C4A | C5A | N7A | 0.0° | 0.1° |
| N9A | C4A | C5A | C6A | 179.8° | 180.0° |
| N9A | C4A | C5A | N3A | 180.0° | 180.0° |
| N9A | C4A | N3A | C2A | 179.9° | 180.0° |
| C8A | N7A | C5A | C6A | 179.8° | 180.0° |
| C8A | N7A | C5A | C4A | 0.0° | 0.1° |
| H8 | C8A | N7A | C5A | 179.9° | 180.0° |
| N7A | C5A | C6A | C4A | 179.8° | 179.9° |
| N7A | C5A | C6A | N1A | 179.9° | 180.0° |
| N7A | C5A | C6A | N6A | 0.2° | 0.0° |
| N7A | C5A | C4A | N3A | 179.9° | 180.0° |
| C5A | C6A | N1A | N6A | 179.9° | 180.0° |
| C5A | C6A | N1A | C2A | 0.0° | 0.1° |
| C6A | C5A | C4A | N3A | 0.2° | 0.0° |
| C5A | C6A | N6A | HN61 | 45.2° | 65.8° |
| C5A | C6A | N6A | HN62 | 74.8° | 120.4° |
| C4A | C5A | C6A | N1A | 0.1° | 0.1° |
| C4A | C5A | C6A | N6A | 180.0° | 179.9° |
| C5A | C4A | N3A | C2A | 0.1° | 0.0° |
| C6A | N1A | C2A | N3A | 0.1° | 0.0° |
| C6A | N1A | C2A | H2 | 179.9° | 179.9° |
| N1A | C6A | N6A | HN61 | 134.7° | 114.2° |
| N1A | C6A | N6A | HN62 | 105.3° | 59.6° |
| N6A | C6A | N1A | C2A | 179.9° | 179.9° |
| C6A | N6A | HN61 | HN62 | 120.0° | 173.7° |
| N1A | C2A | N3A | H2 | 180.0° | 180.0° |
| N1A | C2A | N3A | C4A | 0.1° | 0.0° |
| H2 | C2A | N3A | C4A | 180.0° | 180.0° |
| O2B | C2B | C3B | H2' | 116.1° | 120.0° |
| O2B | C2B | C3B | O3B | 27.5° | 37.0° |
| O2B | C2B | C3B | H3' | 88.0° | 159.1° |
| C3B | C2B | O2B | H3 | 172.6° | 60.1° |
| C2B | C3B | O3B | H3' | 121.2° | 122.4° |
| C2B | C3B | O3B | P3B | 162.2° | 60.0° |
| H2' | C2B | O2B | H3 | 51.7° | 63.3° |
| H2' | C2B | C3B | O3B | 143.6° | 83.0° |
| H2' | C2B | C3B | H3' | 28.0° | 39.1° |
| C3B | O3B | P3B | O7A | 82.8° | 180.0° |
| C3B | O3B | P3B | O8A | 36.8° | 53.0° |
| C3B | O3B | P3B | O9A | 156.0° | 54.4° |
| H3' | C3B | O3B | P3B | 41.0° | 62.4° |
| O3B | P3B | O7A | O8A | 116.1° | 120.9° |
| O3B | P3B | O7A | O9A | 117.6° | 119.0° |
| O3B | P3B | O8A | O9A | 116.4° | 106.8° |
| O3B | P3B | O8A | HO8 | 174.3° | 175.7° |
| O3B | P3B | O9A | HO9 | 94.2° | 173.8° |
| O7A | P3B | O8A | O9A | 126.9° | 126.3° |
| O7A | P3B | O8A | HO8 | 69.1° | 48.8° |
| O7A | P3B | O9A | HO9 | 148.1° | 48.1° |
| O8A | P3B | O9A | HO9 | 21.7° | 78.4° |
| O9A | P3B | O8A | HO8 | 57.8° | 77.5° |
