H5L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1A | C2A | doub | 1.32Å | 1.41Å | Aromatic |
| N1A | C6A | sing | 1.33Å | 1.35Å | Aromatic |
| C2A | N3A | sing | 1.32Å | 1.41Å | Aromatic |
| N6A | C6A | sing | 1.38Å | 1.33Å | |
| C6A | C5A | doub | 1.41Å | 1.34Å | Aromatic |
| N3A | C4A | doub | 1.33Å | 1.36Å | Aromatic |
| C5A | C4A | sing | 1.40Å | 1.34Å | Aromatic |
| C5A | N7A | sing | 1.35Å | 1.34Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.35Å | Aromatic |
| O2B | C2B | sing | 1.43Å | 1.45Å | |
| N7A | C8A | doub | 1.30Å | 1.33Å | Aromatic |
| N9A | C8A | sing | 1.36Å | 1.34Å | Aromatic |
| N9A | C1B | sing | 1.47Å | 1.53Å | |
| C2B | C1B | sing | 1.54Å | 1.55Å | |
| C2B | C3B | sing | 1.54Å | 1.59Å | |
| O9A | P3B | doub | 1.48Å | 1.49Å | |
| C1B | O4B | sing | 1.44Å | 1.46Å | |
| O3B | C3B | sing | 1.43Å | 1.51Å | |
| O3B | P3B | sing | 1.61Å | 1.68Å | |
| C3B | C4B | sing | 1.55Å | 1.56Å | |
| P3B | O7A | sing | 1.61Å | 1.62Å | |
| P3B | O8A | sing | 1.61Å | 1.62Å | |
| O4B | C4B | sing | 1.44Å | 1.45Å | |
| C4B | C5B | sing | 1.53Å | 1.54Å | |
| C5B | O5B | sing | 1.43Å | 1.45Å | |
| O5A | P2A | doub | 1.48Å | 1.48Å | |
| O5B | P1A | sing | 1.61Å | 1.63Å | |
| O4A | P2A | sing | 1.61Å | 1.63Å | |
| P2A | O3A | sing | 1.61Å | 1.63Å | |
| P2A | O6A | sing | 1.61Å | 1.59Å | |
| P1A | O3A | sing | 1.61Å | 1.65Å | |
| P1A | O1A | doub | 1.48Å | 1.63Å | |
| P1A | O2A | sing | 1.61Å | 1.49Å | |
| O6A | CCP | sing | 1.43Å | 1.42Å | |
| CCP | CBP | sing | 1.53Å | 1.51Å | |
| OAP | CAP | sing | 1.43Å | 1.43Å | |
| CBP | CDP | sing | 1.53Å | 1.54Å | |
| CBP | CEP | sing | 1.53Å | 1.53Å | |
| CBP | CAP | sing | 1.53Å | 1.55Å | |
| CAP | C9P | sing | 1.51Å | 1.55Å | |
| C9P | O9P | doub | 1.21Å | 1.24Å | |
| C9P | N8P | sing | 1.35Å | 1.36Å | |
| N8P | C7P | sing | 1.46Å | 1.46Å | |
| C7P | C6P | sing | 1.53Å | 1.55Å | |
| C6P | C5P | sing | 1.51Å | 1.54Å | |
| C5P | N4P | sing | 1.35Å | 1.35Å | |
| C5P | O5P | doub | 1.21Å | 1.23Å | |
| N4P | C3P | sing | 1.46Å | 1.48Å | |
| C3P | C2P | sing | 1.53Å | 1.53Å | |
| C2P | S1P | sing | 1.81Å | 1.84Å | |
| O10 | C9 | doub | 1.22Å | 1.24Å | |
| C9 | S1P | sing | 1.76Å | 1.79Å | |
| C9 | C8 | sing | 1.46Å | 1.55Å | |
| C8 | C7 | doub | 1.35Å | 1.54Å | |
| C7 | C4 | sing | 1.47Å | 1.40Å | |
| C5 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.40Å | 1.41Å | Aromatic |
| O13 | C6 | sing | 1.36Å | 1.37Å | |
| C6 | C1 | doub | 1.39Å | 1.41Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | O12 | sing | 1.36Å | 1.37Å | |
| C2A | H1 | sing | 1.08Å | 1.08Å | |
| N6A | H2 | sing | 0.97Å | 1.00Å | |
| N6A | H3 | sing | 0.97Å | 1.00Å | |
| C8A | H4 | sing | 1.08Å | 1.08Å | |
| C1B | H5 | sing | 1.09Å | 1.10Å | |
| C2B | H6 | sing | 1.09Å | 1.10Å | |
| O2B | H7 | sing | 0.97Å | 0.95Å | |
| C3B | H8 | sing | 1.09Å | 1.10Å | |
| O7A | H9 | sing | 0.97Å | 0.95Å | |
| O8A | H10 | sing | 0.97Å | 0.95Å | |
| C4B | H11 | sing | 1.09Å | 1.10Å | |
| C5B | H12 | sing | 1.09Å | 1.10Å | |
| C5B | H13 | sing | 1.09Å | 1.10Å | |
| O2A | H14 | sing | 0.97Å | 0.95Å | |
| O4A | H15 | sing | 0.97Å | 0.95Å | |
| CCP | H16 | sing | 1.09Å | 1.10Å | |
| CCP | H17 | sing | 1.09Å | 1.10Å | |
| CDP | H18 | sing | 1.09Å | 1.10Å | |
| CDP | H19 | sing | 1.09Å | 1.10Å | |
| CDP | H20 | sing | 1.09Å | 1.10Å | |
| CEP | H21 | sing | 1.09Å | 1.10Å | |
| CEP | H22 | sing | 1.09Å | 1.10Å | |
| CEP | H23 | sing | 1.09Å | 1.10Å | |
| CAP | H24 | sing | 1.09Å | 1.10Å | |
| OAP | H25 | sing | 0.97Å | 0.95Å | |
| N8P | H26 | sing | 0.97Å | 1.00Å | |
| C7P | H27 | sing | 1.09Å | 1.10Å | |
| C7P | H28 | sing | 1.09Å | 1.10Å | |
| C6P | H29 | sing | 1.09Å | 1.10Å | |
| C6P | H30 | sing | 1.09Å | 1.10Å | |
| N4P | H31 | sing | 0.97Å | 1.00Å | |
| C3P | H32 | sing | 1.09Å | 1.10Å | |
| C3P | H33 | sing | 1.09Å | 1.10Å | |
| C2P | H34 | sing | 1.09Å | 1.10Å | |
| C2P | H35 | sing | 1.09Å | 1.10Å | |
| C2 | H36 | sing | 1.08Å | 1.08Å | |
| C3 | H37 | sing | 1.08Å | 1.08Å | |
| C5 | H38 | sing | 1.08Å | 1.08Å | |
| C7 | H39 | sing | 1.08Å | 1.08Å | |
| C8 | H40 | sing | 1.08Å | 1.08Å | |
| O12 | H41 | sing | 0.97Å | 0.95Å | |
| O13 | H42 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | N1A | C6A | 118.6° | 121.2° |
| N1A | C2A | N3A | 118.4° | 122.5° |
| N1A | C2A | H1 | 120.8° | 118.8° |
| N1A | C6A | N6A | 121.7° | 120.8° |
| N1A | C6A | C5A | 121.6° | 118.5° |
| C2A | N3A | C4A | 119.9° | 120.6° |
| N3A | C2A | H1 | 120.8° | 118.7° |
| N6A | C6A | C5A | 116.7° | 120.8° |
| C6A | N6A | H2 | 109.5° | 120.0° |
| C6A | N6A | H3 | 109.5° | 120.0° |
| C6A | C5A | C4A | 121.9° | 118.1° |
| C6A | C5A | N7A | 130.1° | 134.7° |
| N3A | C4A | C5A | 119.6° | 119.1° |
| N3A | C4A | N9A | 132.4° | 134.9° |
| C4A | C5A | N7A | 108.0° | 107.2° |
| C5A | C4A | N9A | 108.0° | 105.9° |
| C5A | N7A | C8A | 107.9° | 109.5° |
| C4A | N9A | C8A | 107.4° | 107.5° |
| C4A | N9A | C1B | 134.4° | 126.2° |
| O2B | C2B | C1B | 111.4° | 110.5° |
| O2B | C2B | C3B | 116.0° | 110.5° |
| O2B | C2B | H6 | 110.5° | 110.5° |
| C2B | O2B | H7 | 109.5° | 114.0° |
| N7A | C8A | N9A | 108.8° | 109.9° |
| N7A | C8A | H4 | 125.6° | 125.1° |
| C8A | N9A | C1B | 118.2° | 126.3° |
| N9A | C8A | H4 | 125.6° | 125.0° |
| N9A | C1B | C2B | 118.4° | 110.3° |
| N9A | C1B | O4B | 112.2° | 110.4° |
| N9A | C1B | H5 | 108.2° | 110.3° |
| C1B | C2B | C3B | 100.7° | 104.1° |
| C2B | C1B | O4B | 100.6° | 104.8° |
| C2B | C1B | H5 | 107.9° | 110.5° |
| C1B | C2B | H6 | 109.1° | 110.5° |
| C2B | C3B | O3B | 117.1° | 110.6° |
| C2B | C3B | C4B | 101.6° | 104.1° |
| C3B | C2B | H6 | 108.6° | 110.5° |
| C2B | C3B | H8 | 106.5° | 110.5° |
| O9A | P3B | O3B | 113.6° | 109.5° |
| O9A | P3B | O7A | 110.8° | 109.4° |
| O9A | P3B | O8A | 113.6° | 109.5° |
| C1B | O4B | C4B | 98.2° | 105.3° |
| O4B | C1B | H5 | 109.1° | 110.4° |
| C3B | O3B | P3B | 130.2° | 123.0° |
| O3B | C3B | C4B | 116.5° | 110.5° |
| O3B | C3B | H8 | 107.4° | 110.6° |
| O3B | P3B | O7A | 105.8° | 109.5° |
| O3B | P3B | O8A | 110.1° | 109.5° |
| C3B | C4B | O4B | 101.1° | 104.8° |
| C3B | C4B | C5B | 115.3° | 110.4° |
| C4B | C3B | H8 | 106.9° | 110.5° |
| C3B | C4B | H11 | 109.3° | 110.3° |
| O7A | P3B | O8A | 102.1° | 109.5° |
| P3B | O7A | H9 | 109.5° | 114.0° |
| P3B | O8A | H10 | 109.5° | 114.0° |
| O4B | C4B | C5B | 110.8° | 110.4° |
| O4B | C4B | H11 | 110.8° | 110.5° |
| C4B | C5B | O5B | 107.3° | 109.5° |
| C5B | C4B | H11 | 109.4° | 110.3° |
| C4B | C5B | H12 | 110.0° | 109.5° |
| C4B | C5B | H13 | 110.0° | 109.5° |
| C5B | O5B | P1A | 124.1° | 123.0° |
| O5B | C5B | H12 | 110.0° | 109.5° |
| O5B | C5B | H13 | 110.0° | 109.5° |
| O5A | P2A | O4A | 113.9° | 109.5° |
| O5A | P2A | O3A | 114.1° | 109.5° |
| O5A | P2A | O6A | 107.9° | 109.4° |
| O5B | P1A | O3A | 108.6° | 109.5° |
| O5B | P1A | O1A | 105.5° | 109.5° |
| O5B | P1A | O2A | 113.1° | 109.4° |
| O4A | P2A | O3A | 109.7° | 109.5° |
| O4A | P2A | O6A | 105.0° | 109.5° |
| P2A | O4A | H15 | 109.5° | 114.0° |
| O3A | P2A | O6A | 105.6° | 109.5° |
| P2A | O3A | P1A | 125.3° | 134.0° |
| P2A | O6A | CCP | 119.1° | 123.0° |
| O3A | P1A | O1A | 106.3° | 109.5° |
| O3A | P1A | O2A | 110.4° | 109.5° |
| O1A | P1A | O2A | 112.5° | 109.5° |
| P1A | O2A | H14 | 109.5° | 114.0° |
| O6A | CCP | CBP | 107.4° | 109.5° |
| O6A | CCP | H16 | 110.0° | 109.5° |
| O6A | CCP | H17 | 110.0° | 109.4° |
| CCP | CBP | CDP | 108.9° | 109.5° |
| CCP | CBP | CEP | 108.1° | 109.4° |
| CCP | CBP | CAP | 110.2° | 109.4° |
| CBP | CCP | H16 | 110.0° | 109.5° |
| CBP | CCP | H17 | 110.0° | 109.4° |
| OAP | CAP | CBP | 109.8° | 109.5° |
| OAP | CAP | C9P | 111.1° | 109.5° |
| OAP | CAP | H24 | 109.2° | 109.5° |
| CAP | OAP | H25 | 109.5° | 114.0° |
| CDP | CBP | CEP | 109.7° | 109.5° |
| CDP | CBP | CAP | 109.4° | 109.5° |
| CBP | CDP | H18 | 109.5° | 109.5° |
| CBP | CDP | H19 | 109.5° | 109.5° |
| CBP | CDP | H20 | 109.5° | 109.5° |
| CEP | CBP | CAP | 110.5° | 109.5° |
| CBP | CEP | H21 | 109.5° | 109.5° |
| CBP | CEP | H22 | 109.5° | 109.4° |
| CBP | CEP | H23 | 109.5° | 109.4° |
| CBP | CAP | C9P | 111.2° | 109.5° |
| CBP | CAP | H24 | 107.8° | 109.4° |
| CAP | C9P | O9P | 122.3° | 120.0° |
| CAP | C9P | N8P | 113.4° | 120.0° |
| C9P | CAP | H24 | 107.7° | 109.5° |
| O9P | C9P | N8P | 124.3° | 120.0° |
| C9P | N8P | C7P | 125.3° | 120.0° |
| C9P | N8P | H26 | 117.3° | 120.0° |
| N8P | C7P | C6P | 109.7° | 109.5° |
| C7P | N8P | H26 | 117.3° | 120.0° |
| N8P | C7P | H27 | 109.4° | 109.5° |
| N8P | C7P | H28 | 109.4° | 109.4° |
| C7P | C6P | C5P | 108.5° | 109.5° |
| C6P | C7P | H27 | 109.4° | 109.5° |
| C6P | C7P | H28 | 109.4° | 109.4° |
| C7P | C6P | H29 | 109.7° | 109.5° |
| C7P | C6P | H30 | 109.7° | 109.4° |
| C6P | C5P | N4P | 117.0° | 120.0° |
| C6P | C5P | O5P | 120.5° | 119.9° |
| C5P | C6P | H29 | 109.7° | 109.5° |
| C5P | C6P | H30 | 109.7° | 109.4° |
| N4P | C5P | O5P | 122.5° | 120.0° |
| C5P | N4P | C3P | 118.8° | 120.1° |
| C5P | N4P | H31 | 120.6° | 120.0° |
| N4P | C3P | C2P | 114.7° | 109.5° |
| C3P | N4P | H31 | 120.6° | 120.0° |
| N4P | C3P | H32 | 108.1° | 109.5° |
| N4P | C3P | H33 | 108.1° | 109.5° |
| C3P | C2P | S1P | 112.1° | 109.5° |
| C2P | C3P | H32 | 108.1° | 109.5° |
| C2P | C3P | H33 | 108.1° | 109.5° |
| C3P | C2P | H34 | 108.8° | 109.5° |
| C3P | C2P | H35 | 108.8° | 109.5° |
| C2P | S1P | C9 | 95.9° | 100.0° |
| S1P | C2P | H34 | 108.8° | 109.5° |
| S1P | C2P | H35 | 108.8° | 109.4° |
| O10 | C9 | S1P | 121.5° | 120.0° |
| O10 | C9 | C8 | 120.7° | 120.0° |
| S1P | C9 | C8 | 117.7° | 120.0° |
| C9 | C8 | C7 | 117.6° | 120.0° |
| C9 | C8 | H40 | 121.2° | 120.0° |
| C8 | C7 | C4 | 116.5° | 120.0° |
| C8 | C7 | H39 | 121.7° | 120.0° |
| C7 | C8 | H40 | 121.2° | 120.0° |
| C7 | C4 | C5 | 119.6° | 120.1° |
| C7 | C4 | C3 | 120.7° | 120.1° |
| C4 | C7 | H39 | 121.7° | 120.0° |
| C4 | C5 | C6 | 119.3° | 119.8° |
| C5 | C4 | C3 | 119.7° | 119.8° |
| C4 | C5 | H38 | 120.3° | 120.1° |
| C5 | C6 | O13 | 121.9° | 120.0° |
| C5 | C6 | C1 | 120.8° | 120.1° |
| C6 | C5 | H38 | 120.3° | 120.1° |
| C4 | C3 | C2 | 121.1° | 120.0° |
| C4 | C3 | H37 | 119.5° | 120.0° |
| O13 | C6 | C1 | 117.3° | 120.0° |
| C6 | O13 | H42 | 109.5° | 114.0° |
| C6 | C1 | C2 | 120.2° | 120.2° |
| C6 | C1 | O12 | 116.8° | 119.9° |
| C3 | C2 | C1 | 119.0° | 120.2° |
| C3 | C2 | H36 | 120.5° | 119.9° |
| C2 | C3 | H37 | 119.5° | 120.0° |
| C2 | C1 | O12 | 123.1° | 119.9° |
| C1 | C2 | H36 | 120.5° | 119.9° |
| C1 | O12 | H41 | 109.5° | 114.0° |
| H2 | N6A | H3 | 109.5° | 120.0° |
| H12 | C5B | H13 | 109.5° | 109.4° |
| H16 | CCP | H17 | 109.5° | 109.5° |
| H18 | CDP | H19 | 109.5° | 109.5° |
| H18 | CDP | H20 | 109.5° | 109.4° |
| H19 | CDP | H20 | 109.5° | 109.5° |
| H21 | CEP | H22 | 109.5° | 109.5° |
| H21 | CEP | H23 | 109.4° | 109.5° |
| H22 | CEP | H23 | 109.5° | 109.5° |
| H27 | C7P | H28 | 109.5° | 109.5° |
| H29 | C6P | H30 | 109.5° | 109.5° |
| H32 | C3P | H33 | 109.5° | 109.5° |
| H34 | C2P | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1A | C2A | N3A | H1 | 180.0° | 180.0° |
| C2A | N1A | C6A | N6A | 179.9° | 180.0° |
| C2A | N1A | C6A | C5A | 0.1° | 0.0° |
| N1A | C2A | N3A | C4A | 0.3° | 0.0° |
| C6A | N1A | C2A | N3A | 0.2° | 0.0° |
| N1A | C6A | N6A | C5A | 180.0° | 180.0° |
| N1A | C6A | C5A | C4A | 0.1° | 0.0° |
| N1A | C6A | C5A | N7A | 180.0° | 179.9° |
| C6A | N1A | C2A | H1 | 179.8° | 180.0° |
| N1A | C6A | N6A | H2 | 0.0° | 0.0° |
| N1A | C6A | N6A | H3 | 120.0° | 180.0° |
| C2A | N3A | C4A | C5A | 0.4° | 0.0° |
| C2A | N3A | C4A | N9A | 179.5° | 180.0° |
| N6A | C6A | C5A | C4A | 179.9° | 180.0° |
| N6A | C6A | C5A | N7A | 0.0° | 0.1° |
| C6A | N6A | H2 | H3 | 120.0° | 179.9° |
| C6A | C5A | C4A | N3A | 0.2° | 0.1° |
| C6A | C5A | C4A | N7A | 179.9° | 179.9° |
| C6A | C5A | C4A | N9A | 179.7° | 180.0° |
| C6A | C5A | N7A | C8A | 180.0° | 179.9° |
| C5A | C6A | N6A | H2 | 180.0° | 180.0° |
| C5A | C6A | N6A | H3 | 60.0° | 0.1° |
| N3A | C4A | C5A | N9A | 179.9° | 180.0° |
| N3A | C4A | C5A | N7A | 179.9° | 180.0° |
| N3A | C4A | N9A | C8A | 179.6° | 180.0° |
| N3A | C4A | N9A | C1B | 1.7° | 0.0° |
| C4A | N3A | C2A | H1 | 179.7° | 180.0° |
| C4A | C5A | N7A | C8A | 0.1° | 0.1° |
| C5A | C4A | N9A | C8A | 0.5° | 0.0° |
| C5A | C4A | N9A | C1B | 178.5° | 180.0° |
| N7A | C5A | C4A | N9A | 0.2° | 0.0° |
| C5A | N7A | C8A | N9A | 0.4° | 0.0° |
| C5A | N7A | C8A | H4 | 179.6° | 180.0° |
| C4A | N9A | C8A | N7A | 0.5° | 0.0° |
| C4A | N9A | C8A | C1B | 178.4° | 180.0° |
| C4A | N9A | C1B | C2B | 80.2° | 88.2° |
| C4A | N9A | C1B | O4B | 163.3° | 156.5° |
| C4A | N9A | C8A | H4 | 179.5° | 180.0° |
| C4A | N9A | C1B | H5 | 42.9° | 34.2° |
| O2B | C2B | C1B | N9A | 76.7° | 98.6° |
| O2B | C2B | C1B | C3B | 123.6° | 118.6° |
| O2B | C2B | C1B | H6 | 122.3° | 122.7° |
| O2B | C2B | C3B | H6 | 125.1° | 122.7° |
| O2B | C2B | C1B | O4B | 160.8° | 142.6° |
| O2B | C2B | C3B | O3B | 4.7° | 0.0° |
| O2B | C2B | C3B | C4B | 123.5° | 118.7° |
| O2B | C2B | C1B | H5 | 46.5° | 23.7° |
| O2B | C2B | C3B | H8 | 124.8° | 122.7° |
| N7A | C8A | N9A | H4 | 180.0° | 180.0° |
| N7A | C8A | N9A | C1B | 178.9° | 180.0° |
| C8A | N9A | C1B | C2B | 102.0° | 91.8° |
| C8A | N9A | C1B | O4B | 14.5° | 23.5° |
| C8A | N9A | C1B | H5 | 134.9° | 145.8° |
| N9A | C1B | C2B | O4B | 122.5° | 118.8° |
| N9A | C1B | C2B | H5 | 123.2° | 122.3° |
| N9A | C1B | C2B | C3B | 159.7° | 142.8° |
| N9A | C1B | O4B | H5 | 119.9° | 122.2° |
| N9A | C1B | O4B | C4B | 173.6° | 159.3° |
| C1B | N9A | C8A | H4 | 1.1° | 0.0° |
| N9A | C1B | C2B | H6 | 45.6° | 24.1° |
| C1B | C2B | C3B | H6 | 114.5° | 118.7° |
| C2B | C1B | O4B | H5 | 113.4° | 119.0° |
| C1B | C2B | C3B | O3B | 125.1° | 118.6° |
| C1B | C2B | C3B | C4B | 3.1° | 0.0° |
| C2B | C1B | O4B | C4B | 59.7° | 40.5° |
| C1B | C2B | O2B | H7 | 180.0° | 61.5° |
| C1B | C2B | C3B | H8 | 114.8° | 118.7° |
| C3B | C2B | C1B | O4B | 37.2° | 24.0° |
| C2B | C3B | O3B | C4B | 120.6° | 114.7° |
| C2B | C3B | O3B | H8 | 119.7° | 122.7° |
| C2B | C3B | O3B | P3B | 98.8° | 121.4° |
| C2B | C3B | C4B | H8 | 111.4° | 118.6° |
| C2B | C3B | C4B | O4B | 32.2° | 23.9° |
| C2B | C3B | C4B | C5B | 151.7° | 142.8° |
| C3B | C2B | C1B | H5 | 77.1° | 94.9° |
| C3B | C2B | O2B | H7 | 65.6° | 176.1° |
| C2B | C3B | C4B | H11 | 84.7° | 95.0° |
| O9A | P3B | O3B | C3B | 80.8° | 54.9° |
| O9A | P3B | O3B | O7A | 121.7° | 119.9° |
| O9A | P3B | O3B | O8A | 128.7° | 120.0° |
| O9A | P3B | O7A | O8A | 121.3° | 120.0° |
| O9A | P3B | O7A | H9 | 0.0° | 180.0° |
| O9A | P3B | O8A | H10 | 0.0° | 60.0° |
| C1B | O4B | C4B | C3B | 57.2° | 40.5° |
| C1B | O4B | C4B | C5B | 179.9° | 159.4° |
| O4B | C1B | C2B | H6 | 77.0° | 94.7° |
| C1B | O4B | C4B | H11 | 58.5° | 78.3° |
| O3B | C3B | C4B | H8 | 120.0° | 122.7° |
| C3B | O3B | P3B | O7A | 157.5° | 65.0° |
| C3B | O3B | P3B | O8A | 47.9° | 175.0° |
| O3B | C3B | C4B | O4B | 160.7° | 142.6° |
| O3B | C3B | C4B | C5B | 79.7° | 98.5° |
| O3B | C3B | C2B | H6 | 120.4° | 122.7° |
| O3B | C3B | C4B | H11 | 43.9° | 23.7° |
| P3B | O3B | C3B | C4B | 21.8° | 123.9° |
| O3B | P3B | O7A | O8A | 115.2° | 120.0° |
| P3B | O3B | C3B | H8 | 141.5° | 1.2° |
| O3B | P3B | O7A | H9 | 123.5° | 60.0° |
| O3B | P3B | O8A | H10 | 128.7° | 180.0° |
| C3B | C4B | O4B | C5B | 122.7° | 118.9° |
| C3B | C4B | O4B | H11 | 115.7° | 118.8° |
| C3B | C4B | C5B | H11 | 123.5° | 122.2° |
| C3B | C4B | C5B | O5B | 152.4° | 175.0° |
| C4B | C3B | C2B | H6 | 111.4° | 118.6° |
| C3B | C4B | C5B | H12 | 87.9° | 55.0° |
| C3B | C4B | C5B | H13 | 32.7° | 65.0° |
| O7A | P3B | O8A | H10 | 119.3° | 60.0° |
| O8A | P3B | O7A | H9 | 121.3° | 60.0° |
| O4B | C4B | C5B | H11 | 122.4° | 122.4° |
| O4B | C4B | C5B | O5B | 38.4° | 69.6° |
| C4B | O4B | C1B | H5 | 53.7° | 78.5° |
| O4B | C4B | C3B | H8 | 79.3° | 94.7° |
| O4B | C4B | C5B | H12 | 158.0° | 170.4° |
| O4B | C4B | C5B | H13 | 81.3° | 50.4° |
| C4B | C5B | O5B | H12 | 119.7° | 120.0° |
| C4B | C5B | O5B | H13 | 119.6° | 120.0° |
| C4B | C5B | O5B | P1A | 159.9° | 180.0° |
| C5B | C4B | C3B | H8 | 40.3° | 24.2° |
| C4B | C5B | H12 | H13 | 121.0° | 120.0° |
| C5B | O5B | P1A | O3A | 136.2° | 175.0° |
| C5B | O5B | P1A | O1A | 22.5° | 55.0° |
| C5B | O5B | P1A | O2A | 100.9° | 65.0° |
| O5B | C5B | C4B | H11 | 84.1° | 52.8° |
| O5B | C5B | H12 | H13 | 121.0° | 120.0° |
| O5A | P2A | O4A | O3A | 129.2° | 120.0° |
| O5A | P2A | O4A | O6A | 117.8° | 120.0° |
| O5A | P2A | O3A | O6A | 118.3° | 120.0° |
| O5A | P2A | O3A | P1A | 106.0° | 40.0° |
| O5A | P2A | O6A | CCP | 67.5° | 55.0° |
| O5A | P2A | O4A | H15 | 0.0° | 180.0° |
| O5B | P1A | O3A | P2A | 63.0° | 165.0° |
| O5B | P1A | O3A | O1A | 113.1° | 120.0° |
| O5B | P1A | O3A | O2A | 124.6° | 120.0° |
| O5B | P1A | O1A | O2A | 123.8° | 120.0° |
| P1A | O5B | C5B | H12 | 40.2° | 60.0° |
| P1A | O5B | C5B | H13 | 80.5° | 60.0° |
| O5B | P1A | O2A | H14 | 119.4° | 60.0° |
| O4A | P2A | O3A | O6A | 112.6° | 120.0° |
| O4A | P2A | O3A | P1A | 23.2° | 80.0° |
| O4A | P2A | O6A | CCP | 170.7° | 65.0° |
| P2A | O3A | P1A | O1A | 50.1° | 45.0° |
| P2A | O3A | P1A | O2A | 172.4° | 75.0° |
| O3A | P2A | O6A | CCP | 54.8° | 175.0° |
| O3A | P2A | O4A | H15 | 129.2° | 59.9° |
| O6A | P2A | O3A | P1A | 135.8° | 160.0° |
| P2A | O6A | CCP | CBP | 136.2° | 180.0° |
| O6A | P2A | O4A | H15 | 117.8° | 60.1° |
| P2A | O6A | CCP | H16 | 16.4° | 60.0° |
| P2A | O6A | CCP | H17 | 104.2° | 60.0° |
| O3A | P1A | O1A | O2A | 120.9° | 120.0° |
| O3A | P1A | O2A | H14 | 118.6° | 59.9° |
| O1A | P1A | O2A | H14 | 0.0° | 180.0° |
| O6A | CCP | CBP | H16 | 119.7° | 120.0° |
| O6A | CCP | CBP | H17 | 119.7° | 119.9° |
| O6A | CCP | CBP | CDP | 21.3° | 60.0° |
| O6A | CCP | CBP | CEP | 140.4° | 60.0° |
| O6A | CCP | CBP | CAP | 98.7° | 180.0° |
| O6A | CCP | H16 | H17 | 120.9° | 120.0° |
| CCP | CBP | CAP | OAP | 37.6° | 65.7° |
| CCP | CBP | CDP | CEP | 118.2° | 120.0° |
| CCP | CBP | CDP | CAP | 120.5° | 120.0° |
| CCP | CBP | CEP | CAP | 120.7° | 120.0° |
| CCP | CBP | CAP | C9P | 160.9° | 54.3° |
| CBP | CCP | H16 | H17 | 120.9° | 120.0° |
| CCP | CBP | CDP | H18 | 180.0° | 173.6° |
| CCP | CBP | CDP | H19 | 60.0° | 53.6° |
| CCP | CBP | CDP | H20 | 60.0° | 66.4° |
| CCP | CBP | CEP | H21 | 180.0° | 56.6° |
| CCP | CBP | CEP | H22 | 60.0° | 63.4° |
| CCP | CBP | CEP | H23 | 60.0° | 176.6° |
| CCP | CBP | CAP | H24 | 81.3° | 174.3° |
| OAP | CAP | CBP | CDP | 157.3° | 174.3° |
| OAP | CAP | CBP | CEP | 81.9° | 54.2° |
| OAP | CAP | CBP | C9P | 123.3° | 120.0° |
| OAP | CAP | CBP | H24 | 118.9° | 120.0° |
| OAP | CAP | C9P | H24 | 119.6° | 120.0° |
| OAP | CAP | C9P | O9P | 13.3° | 8.1° |
| OAP | CAP | C9P | N8P | 167.1° | 171.9° |
| CDP | CBP | CEP | CAP | 120.7° | 120.0° |
| CDP | CBP | CAP | C9P | 79.4° | 65.7° |
| CDP | CBP | CCP | H16 | 140.9° | 180.0° |
| CDP | CBP | CCP | H17 | 98.4° | 60.0° |
| CBP | CDP | H18 | H19 | 120.0° | 120.0° |
| CBP | CDP | H18 | H20 | 120.0° | 120.0° |
| CBP | CDP | H19 | H20 | 120.0° | 120.0° |
| CDP | CBP | CEP | H21 | 61.3° | 63.4° |
| CDP | CBP | CEP | H22 | 178.7° | 176.6° |
| CDP | CBP | CEP | H23 | 58.7° | 56.6° |
| CDP | CBP | CAP | H24 | 38.4° | 54.3° |
| CEP | CBP | CAP | C9P | 41.4° | 174.3° |
| CEP | CBP | CCP | H16 | 99.9° | 60.0° |
| CEP | CBP | CCP | H17 | 20.7° | 180.0° |
| CEP | CBP | CDP | H18 | 61.8° | 66.4° |
| CEP | CBP | CDP | H19 | 58.2° | 173.6° |
| CEP | CBP | CDP | H20 | 178.2° | 53.5° |
| CBP | CEP | H21 | H22 | 120.0° | 120.0° |
| CBP | CEP | H21 | H23 | 120.0° | 119.9° |
| CBP | CEP | H22 | H23 | 120.0° | 119.9° |
| CEP | CBP | CAP | H24 | 159.3° | 65.8° |
| CBP | CAP | C9P | H24 | 117.8° | 120.0° |
| CBP | CAP | C9P | O9P | 109.2° | 111.9° |
| CBP | CAP | C9P | N8P | 70.4° | 68.1° |
| CAP | CBP | CCP | H16 | 21.0° | 60.0° |
| CAP | CBP | CCP | H17 | 141.6° | 60.0° |
| CAP | CBP | CDP | H18 | 59.5° | 53.7° |
| CAP | CBP | CDP | H19 | 179.5° | 66.4° |
| CAP | CBP | CDP | H20 | 60.5° | 173.6° |
| CAP | CBP | CEP | H21 | 59.3° | 176.6° |
| CAP | CBP | CEP | H22 | 60.7° | 56.5° |
| CAP | CBP | CEP | H23 | 179.3° | 63.5° |
| CBP | CAP | OAP | H25 | 117.7° | 60.0° |
| CAP | C9P | O9P | N8P | 179.6° | 180.0° |
| CAP | C9P | N8P | C7P | 177.9° | 175.6° |
| C9P | CAP | OAP | H25 | 5.7° | 60.0° |
| CAP | C9P | N8P | H26 | 2.1° | 4.5° |
| O9P | C9P | N8P | C7P | 1.7° | 4.4° |
| O9P | C9P | CAP | H24 | 132.9° | 128.1° |
| O9P | C9P | N8P | H26 | 178.3° | 175.5° |
| C9P | N8P | C7P | H26 | 180.0° | 179.9° |
| C9P | N8P | C7P | C6P | 103.6° | 180.0° |
| N8P | C9P | CAP | H24 | 47.5° | 51.9° |
| C9P | N8P | C7P | H27 | 136.4° | 60.0° |
| C9P | N8P | C7P | H28 | 16.4° | 60.0° |
| N8P | C7P | C6P | H27 | 120.0° | 120.1° |
| N8P | C7P | C6P | H28 | 120.0° | 119.9° |
| N8P | C7P | C6P | C5P | 173.7° | 180.0° |
| N8P | C7P | H27 | H28 | 119.9° | 120.0° |
| N8P | C7P | C6P | H29 | 53.9° | 59.9° |
| N8P | C7P | C6P | H30 | 66.4° | 60.1° |
| C7P | C6P | C5P | H29 | 119.8° | 120.1° |
| C7P | C6P | C5P | H30 | 119.9° | 119.9° |
| C7P | C6P | C5P | N4P | 153.9° | 179.9° |
| C7P | C6P | C5P | O5P | 24.7° | 0.1° |
| C6P | C7P | N8P | H26 | 76.4° | 0.2° |
| C6P | C7P | H27 | H28 | 119.9° | 120.0° |
| C7P | C6P | H29 | H30 | 120.5° | 120.0° |
| C6P | C5P | N4P | O5P | 178.5° | 180.0° |
| C6P | C5P | N4P | C3P | 177.9° | 180.0° |
| C5P | C6P | C7P | H27 | 66.2° | 59.9° |
| C5P | C6P | C7P | H28 | 53.7° | 60.1° |
| C5P | C6P | H29 | H30 | 120.5° | 120.0° |
| C6P | C5P | N4P | H31 | 2.1° | 0.0° |
| C5P | N4P | C3P | H31 | 180.0° | 180.0° |
| C5P | N4P | C3P | C2P | 149.7° | 180.0° |
| N4P | C5P | C6P | H29 | 86.3° | 60.0° |
| N4P | C5P | C6P | H30 | 34.0° | 60.0° |
| C5P | N4P | C3P | H32 | 89.5° | 60.0° |
| C5P | N4P | C3P | H33 | 28.9° | 60.0° |
| O5P | C5P | N4P | C3P | 0.6° | 0.1° |
| O5P | C5P | C6P | H29 | 95.2° | 120.0° |
| O5P | C5P | C6P | H30 | 144.5° | 120.0° |
| O5P | C5P | N4P | H31 | 179.4° | 180.0° |
| N4P | C3P | C2P | H32 | 120.8° | 120.0° |
| N4P | C3P | C2P | H33 | 120.8° | 120.0° |
| N4P | C3P | C2P | S1P | 169.1° | 180.0° |
| N4P | C3P | H32 | H33 | 117.6° | 120.0° |
| N4P | C3P | C2P | H34 | 70.5° | 60.0° |
| N4P | C3P | C2P | H35 | 48.7° | 60.0° |
| C3P | C2P | S1P | H34 | 120.4° | 120.0° |
| C3P | C2P | S1P | H35 | 120.4° | 120.0° |
| C3P | C2P | S1P | C9 | 119.3° | 180.0° |
| C2P | C3P | N4P | H31 | 30.3° | 0.0° |
| C2P | C3P | H32 | H33 | 117.6° | 120.0° |
| C3P | C2P | H34 | H35 | 118.8° | 120.0° |
| C2P | S1P | C9 | O10 | 22.3° | 0.1° |
| C2P | S1P | C9 | C8 | 157.3° | 180.0° |
| S1P | C2P | C3P | H32 | 48.3° | 59.9° |
| S1P | C2P | C3P | H33 | 70.1° | 60.0° |
| S1P | C2P | H34 | H35 | 118.8° | 120.0° |
| O10 | C9 | S1P | C8 | 179.6° | 179.9° |
| O10 | C9 | C8 | C7 | 178.6° | 0.0° |
| O10 | C9 | C8 | H40 | 1.3° | 180.0° |
| S1P | C9 | C8 | C7 | 1.7° | 180.0° |
| C9 | S1P | C2P | H34 | 120.3° | 59.9° |
| C9 | S1P | C2P | H35 | 1.1° | 60.0° |
| S1P | C9 | C8 | H40 | 178.3° | 0.0° |
| C9 | C8 | C7 | H40 | 180.0° | 180.0° |
| C9 | C8 | C7 | C4 | 177.8° | 180.0° |
| C9 | C8 | C7 | H39 | 2.2° | 0.0° |
| C8 | C7 | C4 | H39 | 180.0° | 180.0° |
| C8 | C7 | C4 | C5 | 7.5° | 180.0° |
| C8 | C7 | C4 | C3 | 174.2° | 0.0° |
| C7 | C4 | C5 | C3 | 178.3° | 180.0° |
| C7 | C4 | C5 | C6 | 179.1° | 179.8° |
| C7 | C4 | C3 | C2 | 178.9° | 179.9° |
| C7 | C4 | C3 | H37 | 1.1° | 0.0° |
| C7 | C4 | C5 | H38 | 1.0° | 0.0° |
| C4 | C7 | C8 | H40 | 2.2° | 0.0° |
| C4 | C5 | C6 | H38 | 180.0° | 179.7° |
| C4 | C5 | C6 | O13 | 179.4° | 180.0° |
| C4 | C5 | C6 | C1 | 0.4° | 0.5° |
| C5 | C4 | C3 | C2 | 0.6° | 0.0° |
| C5 | C4 | C3 | H37 | 179.4° | 179.9° |
| C5 | C4 | C7 | H39 | 172.5° | 0.0° |
| C6 | C5 | C4 | C3 | 0.7° | 0.3° |
| C5 | C6 | O13 | C1 | 179.8° | 179.4° |
| C5 | C6 | C1 | C2 | 0.0° | 0.5° |
| C5 | C6 | C1 | O12 | 179.8° | 179.7° |
| C5 | C6 | O13 | H42 | 180.0° | 90.0° |
| C4 | C3 | C2 | H37 | 180.0° | 179.9° |
| C4 | C3 | C2 | C1 | 0.2° | 0.1° |
| C4 | C3 | C2 | H36 | 179.8° | 180.0° |
| C3 | C4 | C5 | H38 | 179.3° | 180.0° |
| C3 | C4 | C7 | H39 | 5.9° | 180.0° |
| O13 | C6 | C1 | C2 | 179.9° | 179.9° |
| O13 | C6 | C1 | O12 | 0.1° | 0.3° |
| O13 | C6 | C5 | H38 | 0.6° | 0.3° |
| C6 | C1 | C2 | C3 | 0.1° | 0.2° |
| C6 | C1 | C2 | O12 | 179.8° | 179.8° |
| C6 | C1 | C2 | H36 | 179.8° | 179.7° |
| C1 | C6 | C5 | H38 | 179.6° | 179.7° |
| C6 | C1 | O12 | H41 | 180.0° | 90.3° |
| C1 | C6 | O13 | H42 | 0.1° | 90.5° |
| C3 | C2 | C1 | H36 | 180.0° | 179.9° |
| C3 | C2 | C1 | O12 | 179.6° | 180.0° |
| C1 | C2 | C3 | H37 | 179.8° | 180.0° |
| C2 | C1 | O12 | H41 | 0.2° | 90.0° |
| O12 | C1 | C2 | H36 | 0.4° | 0.0° |
| H5 | C1B | C2B | H6 | 168.8° | 146.4° |
| H6 | C2B | O2B | H7 | 58.5° | 61.2° |
| H6 | C2B | C3B | H8 | 0.3° | 0.0° |
| H8 | C3B | C4B | H11 | 163.9° | 146.4° |
| H11 | C4B | C5B | H12 | 35.6° | 67.2° |
| H11 | C4B | C5B | H13 | 156.3° | 172.8° |
| H18 | CDP | H19 | H20 | 120.0° | 120.0° |
| H21 | CEP | H22 | H23 | 120.0° | 120.1° |
| H24 | CAP | OAP | H25 | 124.4° | 180.0° |
| H26 | N8P | C7P | H27 | 43.6° | 119.9° |
| H26 | N8P | C7P | H28 | 163.6° | 120.1° |
| H27 | C7P | C6P | H29 | 173.9° | 180.0° |
| H27 | C7P | C6P | H30 | 53.6° | 60.0° |
| H28 | C7P | C6P | H29 | 66.1° | 60.0° |
| H28 | C7P | C6P | H30 | 173.6° | 180.0° |
| H31 | N4P | C3P | H32 | 90.4° | 120.0° |
| H31 | N4P | C3P | H33 | 151.1° | 120.0° |
| H32 | C3P | C2P | H34 | 168.7° | 180.0° |
| H32 | C3P | C2P | H35 | 72.1° | 60.0° |
| H33 | C3P | C2P | H34 | 50.3° | 60.0° |
| H33 | C3P | C2P | H35 | 169.5° | 180.0° |
| H36 | C2 | C3 | H37 | 0.2° | 0.1° |
| H39 | C7 | C8 | H40 | 177.8° | 180.0° |
