FE9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2' | C2' | sing | 0.00Å | 1.43Å | |
| O6A | C6A | doub | 0.00Å | 1.37Å | |
| C6A | N1A | sing | 0.00Å | 1.37Å | |
| C6A | C5A | sing | 0.00Å | 1.40Å | |
| N1A | C2A | sing | 0.00Å | 1.36Å | |
| N7A | C5A | sing | 0.00Å | 1.35Å | Aromatic |
| N7A | C8A | doub | 0.00Å | 1.35Å | Aromatic |
| C5A | C4A | doub | 0.00Å | 1.39Å | Aromatic |
| C8A | N9A | sing | 0.00Å | 1.34Å | Aromatic |
| C2A | N2A | sing | 0.00Å | 1.37Å | |
| C2A | N3A | doub | 0.00Å | 1.34Å | |
| C2' | C1' | sing | 0.00Å | 1.51Å | |
| C2' | C3' | sing | 0.00Å | 1.51Å | |
| C4A | N3A | sing | 0.00Å | 1.36Å | |
| C4A | N9A | sing | 0.00Å | 1.33Å | Aromatic |
| N9A | C1' | sing | 0.00Å | 1.49Å | |
| O3' | C3' | sing | 0.00Å | 1.42Å | |
| C1' | O4' | sing | 0.00Å | 1.42Å | |
| C3' | C4' | sing | 0.00Å | 1.51Å | |
| O4' | C4' | sing | 0.00Å | 1.42Å | |
| C4' | C5' | sing | 0.00Å | 1.53Å | |
| O1P | P1 | doub | 0.00Å | 1.53Å | |
| C5' | O5' | sing | 0.00Å | 1.43Å | |
| O5' | P1 | sing | 0.00Å | 1.60Å | |
| P1 | O2P | sing | 0.00Å | 1.52Å | |
| P1 | O3P | sing | 0.00Å | 1.61Å | |
| O3P | C4 | sing | 0.00Å | 1.37Å | |
| C3M | C3 | sing | 0.00Å | 1.51Å | |
| C4 | C3 | doub | 0.00Å | 1.42Å | |
| C4 | C5 | sing | 0.00Å | 1.38Å | |
| C5M | C5 | sing | 0.00Å | 1.51Å | |
| C3 | C2 | sing | 0.00Å | 1.40Å | |
| C5 | C6 | doub | 0.00Å | 1.39Å | |
| C2 | O2 | doub | 0.00Å | 1.34Å | |
| C2 | N1 | sing | 0.00Å | 1.30Å | |
| C6 | N1 | sing | 0.00Å | 1.33Å | |
| C6 | C7 | sing | 0.00Å | 1.50Å | |
| N1 | FE | sing | 0.00Å | 2.07Å | |
| O1F | C1F | trip | 0.00Å | 1.19Å | |
| C7 | C8 | sing | 0.00Å | 1.48Å | |
| C1F | FE | sing | 0.00Å | 1.84Å | |
| C8 | FE | sing | 0.00Å | 1.98Å | |
| C8 | O18 | doub | 0.00Å | 1.42Å | |
| FE | C2F | sing | 0.00Å | 1.85Å | |
| C2F | O2F | trip | 0.00Å | 1.20Å | |
| C7 | H8 | sing | 0.00Å | 1.10Å | |
| C5M | H9 | sing | 0.00Å | 1.10Å | |
| C5M | H10 | sing | 0.00Å | 1.10Å | |
| C5M | H11 | sing | 0.00Å | 1.10Å | |
| C3M | H12 | sing | 0.00Å | 1.10Å | |
| C3M | H13 | sing | 0.00Å | 1.10Å | |
| C3M | H14 | sing | 0.00Å | 1.10Å | |
| O2P | H15 | sing | 0.00Å | 0.95Å | |
| C5' | H16 | sing | 0.00Å | 1.10Å | |
| C5' | H17 | sing | 0.00Å | 1.10Å | |
| C4' | H18 | sing | 0.00Å | 1.10Å | |
| C1' | H19 | sing | 0.00Å | 1.10Å | |
| C2' | H20 | sing | 0.00Å | 1.10Å | |
| O2' | H21 | sing | 0.00Å | 0.95Å | |
| C3' | H22 | sing | 0.00Å | 1.10Å | |
| O3' | H23 | sing | 0.00Å | 0.95Å | |
| N2A | H24 | sing | 0.00Å | 1.00Å | |
| N2A | H25 | sing | 0.00Å | 1.00Å | |
| N1A | H26 | sing | 0.00Å | 1.00Å | |
| C8A | H27 | sing | 0.00Å | 1.08Å | |
| C7 | H1 | sing | 0.00Å | 1.10Å | |
| FE | O1 | sing | 0.00Å | 35.36Å | |
| FE | S1 | sing | 0.00Å | 35.36Å | |
| S1 | HS1 | sing | 0.00Å | 0.00Å | |
| O1 | H2 | sing | 0.00Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2' | C2' | C1' | 108.0° | 90.0° |
| O2' | C2' | C3' | 113.1° | 90.0° |
| O2' | C2' | H20 | 112.0° | 90.0° |
| C2' | O2' | H21 | 109.5° | 90.0° |
| O6A | C6A | N1A | 121.1° | 90.0° |
| O6A | C6A | C5A | 119.1° | 90.0° |
| N1A | C6A | C5A | 119.8° | 90.0° |
| C6A | N1A | C2A | 120.1° | 90.0° |
| C6A | N1A | H26 | 119.9° | 90.0° |
| C6A | C5A | N7A | 134.4° | 90.0° |
| C6A | C5A | C4A | 118.8° | 90.0° |
| N1A | C2A | N2A | 121.8° | 90.0° |
| N1A | C2A | N3A | 120.2° | 90.0° |
| C2A | N1A | H26 | 120.0° | 90.0° |
| C5A | N7A | C8A | 108.3° | 90.0° |
| N7A | C5A | C4A | 106.8° | 90.0° |
| N7A | C8A | N9A | 108.7° | 90.0° |
| N7A | C8A | H27 | 125.6° | 90.0° |
| C5A | C4A | N3A | 119.0° | 90.0° |
| C5A | C4A | N9A | 107.8° | 90.0° |
| C8A | N9A | C4A | 108.4° | 90.0° |
| C8A | N9A | C1' | 128.0° | 90.0° |
| N9A | C8A | H27 | 125.6° | 90.0° |
| N2A | C2A | N3A | 118.0° | 90.0° |
| C2A | N2A | H24 | 120.0° | 90.0° |
| C2A | N2A | H25 | 120.0° | 90.0° |
| C2A | N3A | C4A | 122.1° | 90.0° |
| C1' | C2' | C3' | 101.8° | 90.0° |
| C2' | C1' | N9A | 116.1° | 90.0° |
| C2' | C1' | O4' | 103.2° | 90.0° |
| C2' | C1' | H19 | 108.3° | 90.0° |
| C1' | C2' | H20 | 110.8° | 90.0° |
| C2' | C3' | O3' | 109.5° | 90.0° |
| C2' | C3' | C4' | 105.6° | 90.0° |
| C3' | C2' | H20 | 110.7° | 90.0° |
| C2' | C3' | H22 | 111.8° | 90.0° |
| N3A | C4A | N9A | 133.2° | 90.0° |
| C4A | N9A | C1' | 123.6° | 90.0° |
| N9A | C1' | O4' | 111.2° | 90.0° |
| N9A | C1' | H19 | 108.5° | 90.0° |
| O3' | C3' | C4' | 104.4° | 90.0° |
| O3' | C3' | H22 | 113.2° | 90.0° |
| C3' | O3' | H23 | 109.5° | 90.0° |
| C1' | O4' | C4' | 107.6° | 90.0° |
| O4' | C1' | H19 | 109.3° | 90.0° |
| C3' | C4' | O4' | 105.4° | 90.0° |
| C3' | C4' | C5' | 113.6° | 90.0° |
| C3' | C4' | H18 | 108.9° | 90.0° |
| C4' | C3' | H22 | 111.8° | 90.0° |
| O4' | C4' | C5' | 110.1° | 90.0° |
| O4' | C4' | H18 | 110.2° | 90.0° |
| C4' | C5' | O5' | 107.2° | 90.0° |
| C4' | C5' | H16 | 110.0° | 90.0° |
| C4' | C5' | H17 | 110.0° | 90.0° |
| C5' | C4' | H18 | 108.6° | 90.0° |
| O1P | P1 | O5' | 112.0° | 90.0° |
| O1P | P1 | O2P | 119.5° | 90.0° |
| O1P | P1 | O3P | 109.5° | 90.0° |
| C5' | O5' | P1 | 120.8° | 90.0° |
| O5' | C5' | H16 | 110.0° | 90.0° |
| O5' | C5' | H17 | 110.0° | 90.0° |
| O5' | P1 | O2P | 105.2° | 90.0° |
| O5' | P1 | O3P | 98.3° | 90.0° |
| O2P | P1 | O3P | 110.2° | 90.0° |
| P1 | O2P | H15 | 109.5° | 90.0° |
| P1 | O3P | C4 | 124.6° | 90.0° |
| O3P | C4 | C3 | 122.4° | 90.0° |
| O3P | C4 | C5 | 118.6° | 90.0° |
| C3M | C3 | C4 | 122.9° | 90.0° |
| C3M | C3 | C2 | 120.8° | 90.0° |
| C3 | C3M | H12 | 109.5° | 90.0° |
| C3 | C3M | H13 | 109.5° | 90.0° |
| C3 | C3M | H14 | 109.5° | 90.0° |
| C3 | C4 | C5 | 119.0° | 90.0° |
| C4 | C3 | C2 | 116.3° | 90.0° |
| C4 | C5 | C5M | 120.4° | 90.0° |
| C4 | C5 | C6 | 118.6° | 90.0° |
| C5M | C5 | C6 | 121.0° | 90.0° |
| C5 | C5M | H9 | 109.5° | 90.0° |
| C5 | C5M | H10 | 109.5° | 90.0° |
| C5 | C5M | H11 | 109.5° | 90.0° |
| C3 | C2 | O2 | 121.3° | 90.0° |
| C3 | C2 | N1 | 124.8° | 90.0° |
| C5 | C6 | N1 | 123.1° | 90.0° |
| C5 | C6 | C7 | 120.1° | 90.0° |
| O2 | C2 | N1 | 113.9° | 90.0° |
| C2 | N1 | C6 | 118.2° | 90.0° |
| C2 | N1 | FE | 119.4° | 90.0° |
| N1 | C6 | C7 | 116.8° | 90.0° |
| C6 | N1 | FE | 122.3° | 90.0° |
| C6 | C7 | C8 | 99.9° | 90.0° |
| C6 | C7 | H8 | 111.8° | 90.0° |
| C6 | C7 | H1 | 111.8° | 90.0° |
| N1 | FE | C1F | 88.4° | 90.0° |
| N1 | FE | C8 | 71.7° | 90.0° |
| N1 | FE | C2F | 178.5° | 90.0° |
| N1 | FE | O1 | 113.2° | 90.0° |
| N1 | FE | S1 | 113.2° | 90.0° |
| O1F | C1F | FE | 179.2° | 90.0° |
| C7 | C8 | FE | 129.2° | 90.0° |
| C7 | C8 | O18 | 125.0° | 90.0° |
| C8 | C7 | H8 | 111.8° | 90.0° |
| C8 | C7 | H1 | 111.8° | 90.0° |
| C1F | FE | C8 | 95.1° | 90.0° |
| C1F | FE | C2F | 93.1° | 90.0° |
| C1F | FE | O1 | 153.0° | 90.0° |
| C1F | FE | S1 | 153.0° | 90.0° |
| FE | C8 | O18 | 105.8° | 90.0° |
| C8 | FE | C2F | 107.7° | 90.0° |
| C8 | FE | O1 | 77.6° | 90.0° |
| C8 | FE | S1 | 77.6° | 90.0° |
| FE | C2F | O2F | 178.7° | 90.0° |
| C2F | FE | O1 | 65.3° | 90.0° |
| C2F | FE | S1 | 65.3° | 90.0° |
| H8 | C7 | H1 | 109.5° | 90.0° |
| H9 | C5M | H10 | 109.5° | 90.0° |
| H9 | C5M | H11 | 109.4° | 90.0° |
| H10 | C5M | H11 | 109.5° | 90.0° |
| H12 | C3M | H13 | 109.5° | 90.0° |
| H12 | C3M | H14 | 109.4° | 90.0° |
| H13 | C3M | H14 | 109.5° | 90.0° |
| H16 | C5' | H17 | 109.5° | 90.0° |
| H24 | N2A | H25 | 120.0° | 90.0° |
| O1 | FE | S1 | 0.0° | 90.0° |
| FE | O1 | H2 | 90.0° | 90.0° |
| FE | S1 | HS1 | 90.0° | 90.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2' | C2' | C1' | C3' | 119.2° | 90.0° |
| O2' | C2' | C1' | H20 | 123.0° | 90.0° |
| O2' | C2' | C3' | H20 | 126.6° | 90.0° |
| O2' | C2' | C1' | N9A | 81.5° | 90.0° |
| O2' | C2' | C3' | O3' | 25.4° | 90.0° |
| O2' | C2' | C1' | O4' | 156.7° | 90.0° |
| O2' | C2' | C3' | C4' | 137.2° | 90.0° |
| O2' | C2' | C1' | H19 | 40.9° | 90.0° |
| O2' | C2' | C3' | H22 | 100.9° | 90.0° |
| O6A | C6A | N1A | C5A | 179.9° | 90.0° |
| O6A | C6A | N1A | C2A | 179.6° | 90.0° |
| O6A | C6A | C5A | N7A | 0.8° | 90.0° |
| O6A | C6A | C5A | C4A | 178.9° | 90.0° |
| O6A | C6A | N1A | H26 | 0.4° | 90.0° |
| C6A | N1A | C2A | H26 | 180.0° | 90.0° |
| N1A | C6A | C5A | N7A | 179.3° | 90.0° |
| N1A | C6A | C5A | C4A | 0.9° | 90.0° |
| C6A | N1A | C2A | N2A | 179.6° | 90.0° |
| C6A | N1A | C2A | N3A | 0.8° | 90.0° |
| C5A | C6A | N1A | C2A | 0.3° | 90.0° |
| C6A | C5A | N7A | C4A | 179.8° | 90.0° |
| C6A | C5A | N7A | C8A | 179.9° | 90.0° |
| C6A | C5A | C4A | N3A | 0.5° | 90.0° |
| C6A | C5A | C4A | N9A | 179.4° | 90.0° |
| C5A | C6A | N1A | H26 | 179.7° | 90.0° |
| N1A | C2A | N2A | N3A | 178.9° | 90.0° |
| N1A | C2A | N3A | C4A | 1.2° | 90.0° |
| N1A | C2A | N2A | H24 | 178.8° | 90.0° |
| N1A | C2A | N2A | H25 | 1.2° | 90.0° |
| C5A | N7A | C8A | N9A | 0.3° | 90.0° |
| N7A | C5A | C4A | N3A | 179.6° | 90.0° |
| N7A | C5A | C4A | N9A | 0.8° | 90.0° |
| C5A | N7A | C8A | H27 | 179.7° | 90.0° |
| C8A | N7A | C5A | C4A | 0.3° | 90.0° |
| N7A | C8A | N9A | H27 | 180.0° | 90.0° |
| N7A | C8A | N9A | C4A | 0.9° | 90.0° |
| N7A | C8A | N9A | C1' | 179.7° | 90.0° |
| C5A | C4A | N9A | C8A | 1.0° | 90.0° |
| C5A | C4A | N3A | C2A | 0.5° | 90.0° |
| C5A | C4A | N3A | N9A | 178.5° | 90.0° |
| C5A | C4A | N9A | C1' | 179.9° | 90.0° |
| C8A | N9A | C1' | C2' | 36.6° | 90.0° |
| C8A | N9A | C4A | N3A | 179.6° | 90.0° |
| C8A | N9A | C4A | C1' | 178.9° | 90.0° |
| C8A | N9A | C1' | O4' | 81.0° | 90.0° |
| C8A | N9A | C1' | H19 | 158.7° | 90.0° |
| N2A | C2A | N3A | C4A | 179.9° | 90.0° |
| C2A | N2A | H24 | H25 | 180.0° | 90.0° |
| N2A | C2A | N1A | H26 | 0.4° | 90.0° |
| C2A | N3A | C4A | N9A | 177.9° | 90.0° |
| N3A | C2A | N2A | H24 | 0.0° | 90.0° |
| N3A | C2A | N2A | H25 | 180.0° | 90.0° |
| N3A | C2A | N1A | H26 | 179.2° | 90.0° |
| C1' | C2' | C3' | H20 | 117.8° | 90.0° |
| C2' | C1' | N9A | C4A | 144.8° | 90.0° |
| C2' | C1' | N9A | O4' | 117.6° | 90.0° |
| C2' | C1' | N9A | H19 | 122.2° | 90.0° |
| C1' | C2' | C3' | O3' | 90.2° | 90.0° |
| C2' | C1' | O4' | H19 | 115.0° | 90.0° |
| C1' | C2' | C3' | C4' | 21.7° | 90.0° |
| C2' | C1' | O4' | C4' | 40.8° | 90.0° |
| C1' | C2' | O2' | H21 | 180.0° | 90.0° |
| C1' | C2' | C3' | H22 | 143.5° | 90.0° |
| C3' | C2' | C1' | N9A | 159.3° | 90.0° |
| C2' | C3' | O3' | C4' | 112.7° | 90.0° |
| C2' | C3' | O3' | H22 | 125.5° | 90.0° |
| C3' | C2' | C1' | O4' | 37.5° | 90.0° |
| C2' | C3' | C4' | H22 | 121.8° | 90.0° |
| C2' | C3' | C4' | O4' | 1.5° | 90.0° |
| C2' | C3' | C4' | C5' | 122.2° | 90.0° |
| C2' | C3' | C4' | H18 | 116.6° | 90.0° |
| C3' | C2' | C1' | H19 | 78.4° | 90.0° |
| C3' | C2' | O2' | H21 | 68.2° | 90.0° |
| C2' | C3' | O3' | H23 | 180.0° | 90.0° |
| N3A | C4A | N9A | C1' | 1.5° | 90.0° |
| C4A | N9A | C1' | O4' | 97.7° | 90.0° |
| C4A | N9A | C1' | H19 | 22.6° | 90.0° |
| C4A | N9A | C8A | H27 | 179.2° | 90.0° |
| N9A | C1' | O4' | H19 | 119.8° | 90.0° |
| N9A | C1' | O4' | C4' | 165.9° | 90.0° |
| N9A | C1' | C2' | H20 | 41.6° | 90.0° |
| C1' | N9A | C8A | H27 | 0.4° | 90.0° |
| O3' | C3' | C4' | H22 | 122.8° | 90.0° |
| O3' | C3' | C4' | O4' | 117.0° | 90.0° |
| O3' | C3' | C4' | C5' | 122.4° | 90.0° |
| O3' | C3' | C4' | H18 | 1.2° | 90.0° |
| O3' | C3' | C2' | H20 | 152.0° | 90.0° |
| C1' | O4' | C4' | C3' | 26.4° | 90.0° |
| C1' | O4' | C4' | C5' | 149.3° | 90.0° |
| C1' | O4' | C4' | H18 | 90.9° | 90.0° |
| O4' | C1' | C2' | H20 | 80.3° | 90.0° |
| C3' | C4' | O4' | C5' | 122.9° | 90.0° |
| C3' | C4' | O4' | H18 | 117.3° | 90.0° |
| C3' | C4' | C5' | H18 | 121.4° | 90.0° |
| C3' | C4' | C5' | O5' | 76.6° | 90.0° |
| C3' | C4' | C5' | H16 | 43.0° | 90.0° |
| C3' | C4' | C5' | H17 | 163.7° | 90.0° |
| C4' | C3' | C2' | H20 | 96.1° | 90.0° |
| C4' | C3' | O3' | H23 | 67.3° | 90.0° |
| O4' | C4' | C5' | H18 | 120.7° | 90.0° |
| O4' | C4' | C5' | O5' | 165.4° | 90.0° |
| O4' | C4' | C5' | H16 | 74.9° | 90.0° |
| O4' | C4' | C5' | H17 | 45.8° | 90.0° |
| C4' | O4' | C1' | H19 | 74.3° | 90.0° |
| O4' | C4' | C3' | H22 | 120.2° | 90.0° |
| C4' | C5' | O5' | H16 | 119.6° | 90.0° |
| C4' | C5' | O5' | H17 | 119.6° | 90.0° |
| C4' | C5' | O5' | P1 | 133.6° | 90.0° |
| C4' | C5' | H16 | H17 | 121.0° | 90.0° |
| C5' | C4' | C3' | H22 | 0.4° | 90.0° |
| O1P | P1 | O5' | C5' | 38.7° | 90.0° |
| O1P | P1 | O5' | O2P | 131.3° | 90.0° |
| O1P | P1 | O5' | O3P | 115.0° | 90.0° |
| O1P | P1 | O2P | O3P | 128.1° | 90.0° |
| O1P | P1 | O3P | C4 | 140.3° | 90.0° |
| O1P | P1 | O2P | H15 | 0.0° | 90.0° |
| C5' | O5' | P1 | O2P | 170.0° | 90.0° |
| C5' | O5' | P1 | O3P | 76.3° | 90.0° |
| O5' | C5' | H16 | H17 | 121.0° | 90.0° |
| O5' | C5' | C4' | H18 | 44.7° | 90.0° |
| O5' | P1 | O2P | O3P | 105.1° | 90.0° |
| O5' | P1 | O3P | C4 | 102.7° | 90.0° |
| O5' | P1 | O2P | H15 | 126.8° | 90.0° |
| P1 | O5' | C5' | H16 | 13.9° | 90.0° |
| P1 | O5' | C5' | H17 | 106.8° | 90.0° |
| O2P | P1 | O3P | C4 | 6.9° | 90.0° |
| P1 | O3P | C4 | C3 | 75.5° | 90.0° |
| P1 | O3P | C4 | C5 | 106.3° | 90.0° |
| O3P | P1 | O2P | H15 | 128.1° | 90.0° |
| O3P | C4 | C3 | C3M | 1.8° | 90.0° |
| O3P | C4 | C3 | C5 | 178.2° | 90.0° |
| O3P | C4 | C5 | C5M | 0.0° | 90.0° |
| O3P | C4 | C3 | C2 | 179.8° | 90.0° |
| O3P | C4 | C5 | C6 | 179.2° | 90.0° |
| C3M | C3 | C4 | C2 | 178.4° | 90.0° |
| C3M | C3 | C4 | C5 | 180.0° | 90.0° |
| C3M | C3 | C2 | O2 | 0.6° | 90.0° |
| C3M | C3 | C2 | N1 | 178.8° | 90.0° |
| C3 | C3M | H12 | H13 | 120.0° | 90.0° |
| C3 | C3M | H12 | H14 | 120.0° | 90.0° |
| C3 | C3M | H13 | H14 | 120.0° | 90.0° |
| C3 | C4 | C5 | C5M | 178.3° | 90.0° |
| C3 | C4 | C5 | C6 | 1.0° | 90.0° |
| C4 | C3 | C2 | O2 | 179.0° | 90.0° |
| C4 | C3 | C2 | N1 | 0.4° | 90.0° |
| C4 | C3 | C3M | H12 | 180.0° | 90.0° |
| C4 | C3 | C3M | H13 | 60.0° | 90.0° |
| C4 | C3 | C3M | H14 | 60.0° | 90.0° |
| C4 | C5 | C5M | C6 | 179.2° | 90.0° |
| C5 | C4 | C3 | C2 | 1.6° | 90.0° |
| C4 | C5 | C6 | N1 | 1.0° | 90.0° |
| C4 | C5 | C6 | C7 | 179.8° | 90.0° |
| C4 | C5 | C5M | H9 | 180.0° | 90.0° |
| C4 | C5 | C5M | H10 | 60.0° | 90.0° |
| C4 | C5 | C5M | H11 | 60.0° | 90.0° |
| C5M | C5 | C6 | N1 | 179.8° | 90.0° |
| C5M | C5 | C6 | C7 | 1.0° | 90.0° |
| C5 | C5M | H9 | H10 | 120.0° | 90.0° |
| C5 | C5M | H9 | H11 | 120.0° | 90.0° |
| C5 | C5M | H10 | H11 | 120.0° | 90.0° |
| C3 | C2 | O2 | N1 | 179.5° | 90.0° |
| C3 | C2 | N1 | C6 | 1.5° | 90.0° |
| C3 | C2 | N1 | FE | 177.8° | 90.0° |
| C2 | C3 | C3M | H12 | 1.7° | 90.0° |
| C2 | C3 | C3M | H13 | 118.3° | 90.0° |
| C2 | C3 | C3M | H14 | 121.7° | 90.0° |
| C5 | C6 | N1 | C2 | 2.2° | 90.0° |
| C5 | C6 | N1 | C7 | 178.8° | 90.0° |
| C5 | C6 | N1 | FE | 178.5° | 90.0° |
| C5 | C6 | C7 | C8 | 179.2° | 90.0° |
| C5 | C6 | C7 | H8 | 62.4° | 90.0° |
| C6 | C5 | C5M | H9 | 0.8° | 90.0° |
| C6 | C5 | C5M | H10 | 119.2° | 90.0° |
| C6 | C5 | C5M | H11 | 120.8° | 90.0° |
| C5 | C6 | C7 | H1 | 60.8° | 90.0° |
| O2 | C2 | N1 | C6 | 179.1° | 90.0° |
| O2 | C2 | N1 | FE | 2.7° | 90.0° |
| C2 | N1 | C6 | FE | 176.2° | 90.0° |
| C2 | N1 | C6 | C7 | 179.0° | 90.0° |
| C2 | N1 | FE | C1F | 85.0° | 90.0° |
| C2 | N1 | FE | C8 | 179.1° | 90.0° |
| C2 | N1 | FE | C2F | 112.3° | 90.0° |
| C2 | N1 | FE | O1 | 111.9° | 90.0° |
| C2 | N1 | FE | S1 | 111.9° | 90.0° |
| N1 | C6 | C7 | C8 | 0.4° | 90.0° |
| C6 | N1 | FE | C1F | 98.9° | 90.0° |
| C6 | N1 | FE | C8 | 2.9° | 90.0° |
| C6 | N1 | FE | C2F | 63.9° | 90.0° |
| N1 | C6 | C7 | H8 | 118.8° | 90.0° |
| N1 | C6 | C7 | H1 | 118.0° | 90.0° |
| C6 | N1 | FE | O1 | 64.3° | 90.0° |
| C6 | N1 | FE | S1 | 64.3° | 90.0° |
| C7 | C6 | N1 | FE | 2.8° | 90.0° |
| C6 | C7 | C8 | H8 | 118.4° | 90.0° |
| C6 | C7 | C8 | H1 | 118.4° | 90.0° |
| C6 | C7 | C8 | FE | 2.3° | 90.0° |
| C6 | C7 | C8 | O18 | 179.9° | 90.0° |
| C6 | C7 | H8 | H1 | 124.5° | 90.0° |
| N1 | FE | C1F | O1F | 175.5° | 90.0° |
| N1 | FE | C8 | C7 | 3.0° | 90.0° |
| N1 | FE | C1F | C8 | 71.4° | 90.0° |
| N1 | FE | C1F | C2F | 179.6° | 90.0° |
| N1 | FE | C1F | O1 | 144.1° | 90.0° |
| N1 | FE | C1F | S1 | 144.1° | 90.0° |
| N1 | FE | C8 | C2F | 178.5° | 90.0° |
| N1 | FE | C8 | O1 | 119.8° | 90.0° |
| N1 | FE | C8 | S1 | 119.8° | 90.0° |
| N1 | FE | C8 | O18 | 178.9° | 90.0° |
| N1 | FE | C2F | O1 | 0.4° | 90.0° |
| N1 | FE | C2F | S1 | 0.4° | 90.0° |
| N1 | FE | C2F | O2F | 97.6° | 90.0° |
| N1 | FE | O1 | S1 | 90.0° | 90.0° |
| N1 | FE | S1 | HS1 | 90.0° | 90.0° |
| N1 | FE | O1 | H2 | 90.0° | 90.0° |
| O1F | C1F | FE | C8 | 104.1° | 90.0° |
| O1F | C1F | FE | C2F | 4.0° | 90.0° |
| O1F | C1F | FE | O1 | 31.4° | 90.0° |
| O1F | C1F | FE | S1 | 31.4° | 90.0° |
| C7 | C8 | FE | C1F | 89.5° | 90.0° |
| C7 | C8 | FE | O18 | 178.1° | 90.0° |
| C7 | C8 | FE | C2F | 175.6° | 90.0° |
| C8 | C7 | H8 | H1 | 124.4° | 90.0° |
| C7 | C8 | FE | O1 | 116.8° | 90.0° |
| C7 | C8 | FE | S1 | 116.8° | 90.0° |
| C1F | FE | C8 | C2F | 94.9° | 90.0° |
| C1F | FE | C8 | O1 | 153.6° | 90.0° |
| C1F | FE | C8 | S1 | 153.6° | 90.0° |
| C1F | FE | C8 | O18 | 92.3° | 90.0° |
| C1F | FE | C2F | O1 | 163.1° | 90.0° |
| C1F | FE | C2F | S1 | 163.1° | 90.0° |
| C1F | FE | C2F | O2F | 65.2° | 90.0° |
| C1F | FE | O1 | S1 | 90.0° | 90.0° |
| C1F | FE | S1 | HS1 | 90.0° | 90.0° |
| C1F | FE | O1 | H2 | 90.0° | 90.0° |
| C8 | FE | C2F | O1 | 66.8° | 90.0° |
| C8 | FE | C2F | S1 | 66.8° | 90.0° |
| C8 | FE | C2F | O2F | 31.2° | 90.0° |
| FE | C8 | C7 | H8 | 116.1° | 90.0° |
| FE | C8 | C7 | H1 | 120.8° | 90.0° |
| C8 | FE | O1 | S1 | 90.0° | 90.0° |
| C8 | FE | S1 | HS1 | 90.0° | 90.0° |
| C8 | FE | O1 | H2 | 90.0° | 90.0° |
| O18 | C8 | FE | C2F | 2.6° | 90.0° |
| O18 | C8 | C7 | H8 | 61.7° | 90.0° |
| O18 | C8 | C7 | H1 | 61.4° | 90.0° |
| O18 | C8 | FE | O1 | 61.3° | 90.0° |
| O18 | C8 | FE | S1 | 61.3° | 90.0° |
| C2F | FE | O1 | S1 | 90.0° | 90.0° |
| C2F | FE | S1 | HS1 | 90.0° | 90.0° |
| C2F | FE | O1 | H2 | 90.0° | 90.0° |
| O2F | C2F | FE | O1 | 98.0° | 90.0° |
| O2F | C2F | FE | S1 | 98.0° | 90.0° |
| H9 | C5M | H10 | H11 | 120.0° | 90.0° |
| H12 | C3M | H13 | H14 | 120.0° | 90.0° |
| H16 | C5' | C4' | H18 | 164.4° | 90.0° |
| H17 | C5' | C4' | H18 | 74.9° | 90.0° |
| H18 | C4' | C3' | H22 | 121.6° | 90.0° |
| H19 | C1' | C2' | H20 | 163.9° | 90.0° |
| H20 | C2' | O2' | H21 | 57.7° | 90.0° |
| H20 | C2' | C3' | H22 | 25.7° | 90.0° |
| H22 | C3' | O3' | H23 | 54.6° | 90.0° |
| O1 | FE | S1 | HS1 | 90.0° | 90.0° |
| S1 | FE | O1 | H2 | 90.0° | 90.0° |
