V5V
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | N8 | doub | 1.35Å | 1.35Å | Aromatic |
| C18 | N7 | sing | 1.34Å | 1.34Å | Aromatic |
| N8 | C19 | sing | 1.36Å | 1.36Å | Aromatic |
| N7 | C15 | doub | 1.33Å | 1.33Å | Aromatic |
| C19 | N9 | sing | 1.39Å | 1.39Å | |
| C19 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | N5 | sing | 1.34Å | 1.34Å | Aromatic |
| F | C10 | sing | 1.36Å | 1.36Å | |
| N9 | C20 | sing | 1.44Å | 1.44Å | |
| C11 | N5 | sing | 1.45Å | 1.45Å | |
| C11 | C10 | sing | 1.54Å | 1.54Å | |
| C11 | O4 | sing | 1.46Å | 1.46Å | |
| C16 | N6 | sing | 1.40Å | 1.40Å | Aromatic |
| N5 | C17 | sing | 1.36Å | 1.36Å | Aromatic |
| C10 | C13 | sing | 1.51Å | 1.51Å | |
| O4 | C12 | sing | 1.44Å | 1.44Å | |
| C20 | C23 | sing | 1.50Å | 1.50Å | |
| N6 | C17 | doub | 1.34Å | 1.34Å | Aromatic |
| C22 | C23 | doub | 1.35Å | 1.35Å | |
| C22 | C21 | sing | 1.50Å | 1.50Å | |
| C12 | C13 | sing | 1.51Å | 1.51Å | |
| C12 | C14 | sing | 1.52Å | 1.52Å | |
| O7 | P1 | doub | 1.50Å | 1.50Å | |
| C13 | O5 | sing | 1.41Å | 1.41Å | |
| O5 | P1 | sing | 1.62Å | 1.62Å | |
| C21 | N4 | sing | 1.45Å | 1.45Å | |
| P1 | S | sing | 2.08Å | 2.08Å | |
| P1 | O2 | sing | 1.62Å | 1.62Å | |
| C14 | O6 | sing | 1.42Å | 1.42Å | |
| O6 | P | sing | 1.61Å | 1.61Å | |
| N4 | C9 | sing | 1.39Å | 1.39Å | |
| N1 | C7 | doub | 1.33Å | 1.33Å | Aromatic |
| N1 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| O2 | C4 | sing | 1.41Å | 1.41Å | |
| C7 | N | sing | 1.36Å | 1.36Å | Aromatic |
| C9 | C6 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | N3 | sing | 1.36Å | 1.36Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| P | S1 | sing | 2.07Å | 2.07Å | |
| P | O3 | doub | 1.50Å | 1.50Å | |
| P | O1 | sing | 1.62Å | 1.62Å | |
| C4 | C2 | sing | 1.52Å | 1.52Å | |
| C3 | O1 | sing | 1.41Å | 1.41Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C3 | C | sing | 1.52Å | 1.52Å | |
| N3 | C8 | doub | 1.35Å | 1.35Å | Aromatic |
| N | C5 | sing | 1.35Å | 1.35Å | Aromatic |
| N | C1 | sing | 1.45Å | 1.45Å | |
| C5 | N2 | doub | 1.34Å | 1.34Å | Aromatic |
| C2 | O | sing | 1.44Å | 1.44Å | |
| O | C1 | sing | 1.45Å | 1.45Å | |
| C | C1 | sing | 1.52Å | 1.52Å | |
| C | F1 | sing | 1.36Å | 1.36Å | |
| C8 | N2 | sing | 1.34Å | 1.34Å | Aromatic |
| C4 | H1 | sing | 1.10Å | 1.10Å | |
| C4 | H2 | sing | 1.10Å | 1.10Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.10Å | 1.10Å | |
| C13 | H6 | sing | 1.10Å | 1.10Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C20 | H8 | sing | 1.10Å | 1.10Å | |
| C20 | H9 | sing | 1.10Å | 1.10Å | |
| C21 | H10 | sing | 1.10Å | 1.10Å | |
| C21 | H11 | sing | 1.10Å | 1.10Å | |
| C22 | H12 | sing | 1.08Å | 1.08Å | |
| C | H13 | sing | 1.10Å | 1.10Å | |
| C3 | H14 | sing | 1.10Å | 1.10Å | |
| S1 | H15 | sing | 1.30Å | 1.30Å | |
| C14 | H16 | sing | 1.10Å | 1.10Å | |
| C14 | H17 | sing | 1.10Å | 1.10Å | |
| C12 | H18 | sing | 1.10Å | 1.10Å | |
| S | H19 | sing | 1.30Å | 1.30Å | |
| C2 | H20 | sing | 1.10Å | 1.10Å | |
| C11 | H21 | sing | 1.10Å | 1.10Å | |
| C18 | H22 | sing | 1.08Å | 1.08Å | |
| N9 | H23 | sing | 1.00Å | 1.00Å | |
| C23 | H24 | sing | 1.08Å | 1.08Å | |
| N4 | H25 | sing | 1.00Å | 1.00Å | |
| C1 | H26 | sing | 1.10Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N8 | C18 | N7 | 128.4° | 128.4° |
| C18 | N8 | C19 | 119.1° | 119.1° |
| N8 | C18 | H22 | 115.8° | 115.8° |
| C18 | N7 | C15 | 110.9° | 110.9° |
| N7 | C18 | H22 | 115.8° | 115.8° |
| N8 | C19 | N9 | 120.0° | 120.0° |
| N8 | C19 | C16 | 117.2° | 117.2° |
| N7 | C15 | C16 | 127.1° | 127.1° |
| N7 | C15 | N5 | 119.6° | 119.6° |
| N9 | C19 | C16 | 122.8° | 122.8° |
| C19 | N9 | C20 | 123.3° | 123.3° |
| C19 | N9 | H23 | 105.9° | 105.9° |
| C19 | C16 | C15 | 117.2° | 117.2° |
| C19 | C16 | N6 | 136.5° | 136.5° |
| C16 | C15 | N5 | 113.3° | 113.3° |
| C15 | C16 | N6 | 106.3° | 106.3° |
| C15 | N5 | C11 | 127.9° | 127.9° |
| C15 | N5 | C17 | 100.1° | 100.1° |
| F | C10 | C11 | 110.0° | 110.0° |
| F | C10 | C13 | 108.6° | 108.6° |
| F | C10 | H5 | 114.0° | 114.0° |
| N9 | C20 | C23 | 108.8° | 108.8° |
| N9 | C20 | H8 | 109.7° | 109.6° |
| N9 | C20 | H9 | 109.6° | 109.6° |
| C20 | N9 | H23 | 105.9° | 105.9° |
| N5 | C11 | C10 | 108.7° | 108.7° |
| N5 | C11 | O4 | 111.1° | 111.1° |
| C11 | N5 | C17 | 132.0° | 132.0° |
| N5 | C11 | H21 | 110.7° | 110.7° |
| C10 | C11 | O4 | 106.1° | 106.1° |
| C11 | C10 | C13 | 100.6° | 100.6° |
| C11 | C10 | H5 | 111.2° | 111.2° |
| C10 | C11 | H21 | 109.5° | 109.5° |
| C11 | O4 | C12 | 107.3° | 107.3° |
| O4 | C11 | H21 | 110.6° | 110.6° |
| C16 | N6 | C17 | 102.0° | 102.0° |
| N5 | C17 | N6 | 118.2° | 118.2° |
| N5 | C17 | H7 | 120.9° | 120.9° |
| C10 | C13 | C12 | 100.2° | 100.2° |
| C10 | C13 | O5 | 115.9° | 115.9° |
| C13 | C10 | H5 | 111.6° | 111.6° |
| C10 | C13 | H6 | 109.0° | 109.0° |
| O4 | C12 | C13 | 105.3° | 105.3° |
| O4 | C12 | C14 | 110.3° | 110.3° |
| O4 | C12 | H18 | 110.7° | 110.7° |
| C20 | C23 | C22 | 124.8° | 124.8° |
| C23 | C20 | H8 | 109.6° | 109.7° |
| C23 | C20 | H9 | 109.7° | 109.7° |
| C20 | C23 | H24 | 117.6° | 117.6° |
| N6 | C17 | H7 | 120.9° | 120.9° |
| C23 | C22 | C21 | 124.4° | 124.4° |
| C23 | C22 | H12 | 117.8° | 117.8° |
| C22 | C23 | H24 | 117.6° | 117.6° |
| C22 | C21 | N4 | 107.7° | 107.7° |
| C22 | C21 | H10 | 109.9° | 109.9° |
| C22 | C21 | H11 | 109.9° | 109.9° |
| C21 | C22 | H12 | 117.8° | 117.8° |
| C13 | C12 | C14 | 111.2° | 111.2° |
| C12 | C13 | O5 | 111.9° | 111.9° |
| C12 | C13 | H6 | 108.9° | 108.9° |
| C13 | C12 | H18 | 109.7° | 109.7° |
| C12 | C14 | O6 | 106.8° | 106.8° |
| C12 | C14 | H16 | 110.1° | 110.1° |
| C12 | C14 | H17 | 110.1° | 110.1° |
| C14 | C12 | H18 | 109.6° | 109.6° |
| O7 | P1 | O5 | 111.4° | 111.4° |
| O7 | P1 | S | 110.9° | 110.9° |
| O7 | P1 | O2 | 110.5° | 110.5° |
| C13 | O5 | P1 | 117.2° | 117.2° |
| O5 | C13 | H6 | 110.3° | 110.3° |
| O5 | P1 | S | 109.5° | 109.5° |
| O5 | P1 | O2 | 100.8° | 100.8° |
| C21 | N4 | C9 | 124.3° | 124.3° |
| N4 | C21 | H10 | 109.9° | 109.9° |
| N4 | C21 | H11 | 109.9° | 109.9° |
| C21 | N4 | H25 | 105.7° | 105.7° |
| S | P1 | O2 | 113.4° | 113.4° |
| P1 | S | H19 | 102.0° | 102.0° |
| P1 | O2 | C4 | 116.5° | 116.5° |
| C14 | O6 | P | 118.0° | 118.0° |
| O6 | C14 | H16 | 110.1° | 110.1° |
| O6 | C14 | H17 | 110.1° | 110.1° |
| O6 | P | S1 | 107.9° | 107.9° |
| O6 | P | O3 | 111.2° | 111.2° |
| O6 | P | O1 | 100.6° | 100.6° |
| N4 | C9 | C6 | 126.5° | 126.5° |
| N4 | C9 | N3 | 115.9° | 115.9° |
| C9 | N4 | H25 | 105.6° | 105.6° |
| C7 | N1 | C6 | 102.3° | 102.3° |
| N1 | C7 | N | 118.1° | 118.1° |
| N1 | C7 | H3 | 120.9° | 120.9° |
| N1 | C6 | C9 | 136.2° | 136.2° |
| N1 | C6 | C5 | 106.7° | 106.7° |
| O2 | C4 | C2 | 110.8° | 110.8° |
| O2 | C4 | H1 | 109.1° | 109.1° |
| O2 | C4 | H2 | 109.1° | 109.1° |
| C7 | N | C5 | 100.6° | 100.6° |
| C7 | N | C1 | 129.8° | 129.8° |
| N | C7 | H3 | 121.0° | 121.0° |
| C6 | C9 | N3 | 117.7° | 117.7° |
| C9 | C6 | C5 | 117.1° | 117.1° |
| C9 | N3 | C8 | 118.9° | 118.9° |
| C6 | C5 | N | 112.4° | 112.4° |
| C6 | C5 | N2 | 126.8° | 126.8° |
| S1 | P | O3 | 110.8° | 110.8° |
| S1 | P | O1 | 114.0° | 114.0° |
| P | S1 | H15 | 102.0° | 102.0° |
| O3 | P | O1 | 112.0° | 112.0° |
| P | O1 | C3 | 119.1° | 119.1° |
| C4 | C2 | C3 | 114.1° | 114.1° |
| C4 | C2 | O | 107.6° | 107.6° |
| C2 | C4 | H1 | 109.1° | 109.1° |
| C2 | C4 | H2 | 109.2° | 109.2° |
| C4 | C2 | H20 | 109.2° | 109.2° |
| O1 | C3 | C2 | 113.0° | 113.0° |
| O1 | C3 | C | 112.6° | 112.6° |
| O1 | C3 | H14 | 111.3° | 111.3° |
| C2 | C3 | C | 100.1° | 100.1° |
| C3 | C2 | O | 106.4° | 106.4° |
| C2 | C3 | H14 | 109.6° | 109.6° |
| C3 | C2 | H20 | 109.1° | 109.1° |
| C3 | C | C1 | 102.6° | 102.6° |
| C3 | C | F1 | 109.5° | 109.5° |
| C3 | C | H13 | 111.2° | 111.2° |
| C | C3 | H14 | 109.8° | 109.7° |
| N3 | C8 | N2 | 128.5° | 128.5° |
| N3 | C8 | H4 | 115.8° | 115.8° |
| C5 | N | C1 | 129.5° | 129.5° |
| N | C5 | N2 | 120.8° | 120.8° |
| N | C1 | O | 110.5° | 110.5° |
| N | C1 | C | 109.4° | 109.4° |
| N | C1 | H26 | 110.6° | 110.6° |
| C5 | N2 | C8 | 111.0° | 111.0° |
| C2 | O | C1 | 108.2° | 108.2° |
| O | C2 | H20 | 110.3° | 110.3° |
| O | C1 | C | 106.0° | 106.0° |
| O | C1 | H26 | 110.6° | 110.6° |
| C1 | C | F1 | 108.0° | 108.0° |
| C1 | C | H13 | 111.1° | 111.1° |
| C | C1 | H26 | 109.6° | 109.6° |
| F1 | C | H13 | 113.7° | 113.7° |
| N2 | C8 | H4 | 115.7° | 115.7° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H8 | C20 | H9 | 109.5° | 109.5° |
| H10 | C21 | H11 | 109.4° | 109.4° |
| H16 | C14 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N8 | C18 | N7 | H22 | 180.0° | 180.0° |
| N8 | C18 | N7 | C15 | 0.3° | 0.3° |
| C18 | N8 | C19 | N9 | 178.7° | 178.7° |
| C18 | N8 | C19 | C16 | 0.3° | 0.3° |
| N7 | C18 | N8 | C19 | 0.1° | 0.1° |
| C18 | N7 | C15 | C16 | 0.2° | 0.2° |
| C18 | N7 | C15 | N5 | 179.7° | 179.7° |
| N8 | C19 | N9 | C16 | 178.3° | 178.3° |
| N8 | C19 | C16 | C15 | 0.4° | 0.4° |
| N8 | C19 | N9 | C20 | 172.3° | 172.3° |
| N8 | C19 | C16 | N6 | 180.0° | 180.0° |
| C19 | N8 | C18 | H22 | 179.9° | 179.9° |
| N8 | C19 | N9 | H23 | 50.4° | 50.4° |
| N7 | C15 | C16 | C19 | 0.2° | 0.2° |
| N7 | C15 | C16 | N5 | 179.5° | 179.5° |
| N7 | C15 | N5 | C11 | 1.5° | 1.5° |
| N7 | C15 | C16 | N6 | 179.9° | 179.9° |
| N7 | C15 | N5 | C17 | 179.8° | 179.8° |
| C15 | N7 | C18 | H22 | 179.7° | 179.7° |
| N9 | C19 | C16 | C15 | 178.8° | 178.8° |
| C19 | N9 | C20 | H23 | 121.9° | 121.9° |
| N9 | C19 | C16 | N6 | 1.7° | 1.7° |
| C19 | N9 | C20 | C23 | 94.0° | 94.0° |
| C19 | N9 | C20 | H8 | 146.1° | 146.1° |
| C19 | N9 | C20 | H9 | 25.9° | 25.9° |
| C19 | C16 | C15 | N6 | 179.7° | 179.7° |
| C19 | C16 | C15 | N5 | 179.4° | 179.4° |
| C16 | C19 | N9 | C20 | 6.0° | 6.0° |
| C19 | C16 | N6 | C17 | 179.7° | 179.7° |
| C16 | C19 | N9 | H23 | 128.0° | 128.0° |
| C16 | C15 | N5 | C11 | 178.9° | 178.9° |
| C16 | C15 | N5 | C17 | 0.6° | 0.6° |
| C15 | C16 | N6 | C17 | 0.1° | 0.1° |
| C15 | N5 | C11 | C17 | 177.8° | 177.8° |
| C15 | N5 | C11 | C10 | 78.1° | 78.1° |
| C15 | N5 | C11 | O4 | 165.5° | 165.5° |
| N5 | C15 | C16 | N6 | 0.3° | 0.3° |
| C15 | N5 | C17 | N6 | 0.7° | 0.7° |
| C15 | N5 | C17 | H7 | 179.3° | 179.3° |
| C15 | N5 | C11 | H21 | 42.2° | 42.2° |
| F | C10 | C11 | N5 | 156.8° | 156.8° |
| F | C10 | C11 | C13 | 114.4° | 114.4° |
| F | C10 | C11 | H5 | 127.3° | 127.3° |
| F | C10 | C11 | O4 | 83.6° | 83.6° |
| F | C10 | C13 | H5 | 126.5° | 126.5° |
| F | C10 | C13 | C12 | 72.4° | 72.4° |
| F | C10 | C13 | O5 | 48.1° | 48.1° |
| F | C10 | C13 | H6 | 173.3° | 173.3° |
| F | C10 | C11 | H21 | 35.7° | 35.7° |
| N9 | C20 | C23 | H8 | 119.9° | 119.9° |
| N9 | C20 | C23 | H9 | 119.9° | 119.9° |
| N9 | C20 | C23 | C22 | 3.5° | 3.5° |
| N9 | C20 | H8 | H9 | 120.3° | 120.3° |
| N9 | C20 | C23 | H24 | 176.6° | 176.6° |
| N5 | C11 | C10 | O4 | 119.6° | 119.6° |
| N5 | C11 | C10 | H21 | 121.1° | 121.1° |
| N5 | C11 | O4 | H21 | 123.4° | 123.4° |
| N5 | C11 | C10 | C13 | 88.8° | 88.8° |
| N5 | C11 | O4 | C12 | 112.8° | 112.8° |
| C11 | N5 | C17 | N6 | 179.0° | 179.0° |
| N5 | C11 | C10 | H5 | 29.6° | 29.6° |
| C11 | N5 | C17 | H7 | 1.0° | 1.0° |
| C10 | C11 | O4 | H21 | 118.6° | 118.6° |
| C10 | C11 | N5 | C17 | 99.7° | 99.7° |
| C11 | C10 | C13 | H5 | 118.0° | 118.0° |
| C10 | C11 | O4 | C12 | 5.2° | 5.2° |
| C11 | C10 | C13 | C12 | 43.0° | 43.0° |
| C11 | C10 | C13 | O5 | 163.6° | 163.6° |
| C11 | C10 | C13 | H6 | 71.3° | 71.3° |
| O4 | C11 | N5 | C17 | 16.7° | 16.7° |
| O4 | C11 | C10 | C13 | 30.8° | 30.8° |
| C11 | O4 | C12 | C13 | 22.8° | 22.8° |
| C11 | O4 | C12 | C14 | 142.9° | 142.9° |
| O4 | C11 | C10 | H5 | 149.2° | 149.2° |
| C11 | O4 | C12 | H18 | 95.6° | 95.6° |
| C16 | N6 | C17 | N5 | 0.6° | 0.6° |
| C16 | N6 | C17 | H7 | 179.4° | 179.4° |
| N5 | C17 | N6 | H7 | 180.0° | 180.0° |
| C17 | N5 | C11 | H21 | 140.0° | 140.0° |
| C10 | C13 | C12 | O4 | 41.9° | 41.9° |
| C10 | C13 | C12 | O5 | 123.4° | 123.4° |
| C10 | C13 | C12 | H6 | 114.3° | 114.3° |
| C10 | C13 | C12 | C14 | 161.4° | 161.4° |
| C10 | C13 | O5 | H6 | 124.5° | 124.5° |
| C10 | C13 | O5 | P1 | 76.9° | 76.9° |
| C10 | C13 | C12 | H18 | 77.2° | 77.2° |
| C13 | C10 | C11 | H21 | 150.1° | 150.1° |
| O4 | C12 | C13 | C14 | 119.5° | 119.5° |
| O4 | C12 | C13 | H18 | 119.1° | 119.1° |
| O4 | C12 | C14 | H18 | 122.1° | 122.1° |
| O4 | C12 | C13 | O5 | 165.3° | 165.3° |
| O4 | C12 | C14 | O6 | 59.6° | 59.6° |
| O4 | C12 | C13 | H6 | 72.5° | 72.5° |
| O4 | C12 | C14 | H16 | 60.0° | 60.0° |
| O4 | C12 | C14 | H17 | 179.2° | 179.2° |
| C12 | O4 | C11 | H21 | 123.8° | 123.8° |
| C20 | C23 | C22 | H24 | 180.0° | 180.0° |
| C20 | C23 | C22 | C21 | 179.8° | 179.8° |
| C23 | C20 | H8 | H9 | 120.3° | 120.3° |
| C20 | C23 | C22 | H12 | 0.2° | 0.2° |
| C23 | C20 | N9 | H23 | 27.9° | 27.9° |
| C23 | C22 | C21 | H12 | 180.0° | 180.0° |
| C23 | C22 | C21 | N4 | 8.8° | 8.8° |
| C22 | C23 | C20 | H8 | 116.5° | 116.4° |
| C22 | C23 | C20 | H9 | 123.3° | 123.3° |
| C23 | C22 | C21 | H10 | 110.9° | 110.9° |
| C23 | C22 | C21 | H11 | 128.6° | 128.6° |
| C22 | C21 | N4 | H10 | 119.7° | 119.7° |
| C22 | C21 | N4 | H11 | 119.7° | 119.7° |
| C22 | C21 | N4 | C9 | 93.7° | 93.7° |
| C22 | C21 | H10 | H11 | 120.8° | 120.8° |
| C21 | C22 | C23 | H24 | 0.1° | 0.1° |
| C22 | C21 | N4 | H25 | 144.3° | 144.3° |
| C13 | C12 | C14 | H18 | 121.4° | 121.4° |
| C12 | C13 | O5 | H6 | 121.5° | 121.5° |
| C12 | C13 | O5 | P1 | 169.0° | 169.0° |
| C13 | C12 | C14 | O6 | 56.9° | 56.9° |
| C12 | C13 | C10 | H5 | 161.0° | 161.0° |
| C13 | C12 | C14 | H16 | 176.4° | 176.4° |
| C13 | C12 | C14 | H17 | 62.7° | 62.7° |
| C14 | C12 | C13 | O5 | 75.2° | 75.2° |
| C12 | C14 | O6 | H16 | 119.6° | 119.6° |
| C12 | C14 | O6 | H17 | 119.6° | 119.6° |
| C12 | C14 | O6 | P | 176.2° | 176.2° |
| C14 | C12 | C13 | H6 | 47.1° | 47.1° |
| C12 | C14 | H16 | H17 | 121.2° | 121.2° |
| O7 | P1 | O5 | C13 | 37.9° | 37.9° |
| O7 | P1 | O5 | S | 123.0° | 123.0° |
| O7 | P1 | O5 | O2 | 117.3° | 117.3° |
| O7 | P1 | S | O2 | 125.0° | 125.0° |
| O7 | P1 | O2 | C4 | 174.9° | 174.9° |
| O7 | P1 | S | H19 | 0.0° | 0.0° |
| C13 | O5 | P1 | S | 161.0° | 161.0° |
| C13 | O5 | P1 | O2 | 79.3° | 79.3° |
| O5 | C13 | C10 | H5 | 78.4° | 78.4° |
| O5 | C13 | C12 | H18 | 46.2° | 46.2° |
| O5 | P1 | S | O2 | 111.6° | 111.6° |
| O5 | P1 | O2 | C4 | 67.3° | 67.3° |
| P1 | O5 | C13 | H6 | 47.6° | 47.6° |
| O5 | P1 | S | H19 | 123.3° | 123.3° |
| C21 | N4 | C9 | H25 | 122.0° | 122.0° |
| C21 | N4 | C9 | C6 | 4.3° | 4.3° |
| C21 | N4 | C9 | N3 | 174.4° | 174.4° |
| N4 | C21 | H10 | H11 | 120.8° | 120.8° |
| N4 | C21 | C22 | H12 | 171.2° | 171.2° |
| S | P1 | O2 | C4 | 49.6° | 49.6° |
| P1 | O2 | C4 | C2 | 164.8° | 164.8° |
| P1 | O2 | C4 | H1 | 44.6° | 44.6° |
| P1 | O2 | C4 | H2 | 75.0° | 75.0° |
| O2 | P1 | S | H19 | 125.0° | 125.0° |
| C14 | O6 | P | S1 | 163.9° | 163.9° |
| C14 | O6 | P | O3 | 42.2° | 42.2° |
| C14 | O6 | P | O1 | 76.4° | 76.4° |
| O6 | C14 | H16 | H17 | 121.2° | 121.2° |
| O6 | C14 | C12 | H18 | 178.3° | 178.3° |
| O6 | P | S1 | O3 | 121.9° | 121.9° |
| O6 | P | S1 | O1 | 110.8° | 110.8° |
| O6 | P | O3 | O1 | 111.6° | 111.6° |
| O6 | P | O1 | C3 | 68.9° | 68.9° |
| O6 | P | S1 | H15 | 121.9° | 121.9° |
| P | O6 | C14 | H16 | 64.3° | 64.3° |
| P | O6 | C14 | H17 | 56.6° | 56.6° |
| N4 | C9 | C6 | N1 | 1.4° | 1.4° |
| N4 | C9 | C6 | N3 | 178.7° | 178.7° |
| N4 | C9 | C6 | C5 | 179.2° | 179.2° |
| N4 | C9 | N3 | C8 | 179.3° | 179.3° |
| C9 | N4 | C21 | H10 | 26.0° | 26.0° |
| C9 | N4 | C21 | H11 | 146.5° | 146.5° |
| N1 | C7 | N | H3 | 180.0° | 180.0° |
| C7 | N1 | C6 | C9 | 179.5° | 179.5° |
| C7 | N1 | C6 | C5 | 0.0° | 0.0° |
| N1 | C7 | N | C5 | 0.5° | 0.5° |
| N1 | C7 | N | C1 | 179.0° | 179.0° |
| C6 | N1 | C7 | N | 0.4° | 0.4° |
| N1 | C6 | C9 | C5 | 179.5° | 179.5° |
| N1 | C6 | C9 | N3 | 180.0° | 180.0° |
| N1 | C6 | C5 | N | 0.3° | 0.3° |
| N1 | C6 | C5 | N2 | 179.9° | 179.9° |
| C6 | N1 | C7 | H3 | 179.6° | 179.6° |
| O2 | C4 | C2 | H1 | 120.2° | 120.2° |
| O2 | C4 | C2 | H2 | 120.2° | 120.2° |
| O2 | C4 | C2 | C3 | 55.3° | 55.3° |
| O2 | C4 | C2 | O | 62.5° | 62.5° |
| O2 | C4 | H1 | H2 | 119.4° | 119.4° |
| O2 | C4 | C2 | H20 | 177.8° | 177.8° |
| C7 | N | C5 | C6 | 0.5° | 0.5° |
| C7 | N | C5 | C1 | 178.5° | 178.5° |
| C7 | N | C5 | N2 | 179.9° | 179.9° |
| C7 | N | C1 | O | 18.5° | 18.5° |
| C7 | N | C1 | C | 97.8° | 97.8° |
| C7 | N | C1 | H26 | 141.3° | 141.3° |
| C6 | C9 | N3 | C8 | 0.5° | 0.5° |
| C9 | C6 | C5 | N | 179.3° | 179.3° |
| C9 | C6 | C5 | N2 | 0.3° | 0.3° |
| C6 | C9 | N4 | H25 | 117.7° | 117.7° |
| N3 | C9 | C6 | C5 | 0.5° | 0.5° |
| C9 | N3 | C8 | N2 | 0.1° | 0.1° |
| C9 | N3 | C8 | H4 | 179.8° | 179.8° |
| N3 | C9 | N4 | H25 | 63.6° | 63.6° |
| C6 | C5 | N | N2 | 179.6° | 179.6° |
| C6 | C5 | N | C1 | 178.9° | 178.9° |
| C6 | C5 | N2 | C8 | 0.0° | 0.0° |
| S1 | P | O3 | O1 | 128.5° | 128.5° |
| S1 | P | O1 | C3 | 46.3° | 46.3° |
| O3 | P | O1 | C3 | 173.0° | 173.0° |
| O3 | P | S1 | H15 | 0.0° | 0.0° |
| P | O1 | C3 | C2 | 159.0° | 159.0° |
| P | O1 | C3 | C | 88.5° | 88.5° |
| P | O1 | C3 | H14 | 35.2° | 35.2° |
| O1 | P | S1 | H15 | 127.4° | 127.4° |
| C4 | C2 | C3 | O1 | 85.5° | 85.5° |
| C4 | C2 | C3 | O | 118.5° | 118.5° |
| C4 | C2 | C3 | H20 | 122.5° | 122.5° |
| C4 | C2 | C3 | C | 154.5° | 154.5° |
| C4 | C2 | O | H20 | 119.1° | 119.1° |
| C4 | C2 | O | C1 | 140.5° | 140.5° |
| C2 | C4 | H1 | H2 | 119.4° | 119.4° |
| C4 | C2 | C3 | H14 | 39.2° | 39.2° |
| O1 | C3 | C2 | C | 120.0° | 120.0° |
| O1 | C3 | C2 | H14 | 124.7° | 124.7° |
| O1 | C3 | C | H14 | 124.6° | 124.6° |
| O1 | C3 | C2 | O | 156.0° | 156.0° |
| O1 | C3 | C | C1 | 159.9° | 159.9° |
| O1 | C3 | C | F1 | 45.3° | 45.3° |
| O1 | C3 | C | H13 | 81.2° | 81.2° |
| O1 | C3 | C2 | H20 | 37.0° | 37.0° |
| C2 | C3 | C | H14 | 115.2° | 115.2° |
| C3 | C2 | O | H20 | 118.2° | 118.2° |
| C3 | C2 | O | C1 | 17.8° | 17.8° |
| C2 | C3 | C | C1 | 39.6° | 39.6° |
| C2 | C3 | C | F1 | 74.9° | 74.9° |
| C3 | C2 | C4 | H1 | 64.9° | 64.9° |
| C3 | C2 | C4 | H2 | 175.5° | 175.5° |
| C2 | C3 | C | H13 | 158.5° | 158.5° |
| C3 | C | C1 | N | 88.4° | 88.4° |
| C | C3 | C2 | O | 36.0° | 36.0° |
| C3 | C | C1 | O | 30.7° | 30.7° |
| C3 | C | C1 | F1 | 115.6° | 115.6° |
| C3 | C | C1 | H13 | 118.9° | 118.9° |
| C3 | C | F1 | H13 | 125.1° | 125.1° |
| C | C3 | C2 | H20 | 82.9° | 82.9° |
| C3 | C | C1 | H26 | 150.1° | 150.1° |
| N3 | C8 | N2 | C5 | 0.1° | 0.1° |
| N3 | C8 | N2 | H4 | 180.0° | 180.0° |
| C5 | N | C1 | O | 163.5° | 163.5° |
| C5 | N | C1 | C | 80.2° | 80.2° |
| N | C5 | N2 | C8 | 179.6° | 179.6° |
| C5 | N | C7 | H3 | 179.4° | 179.4° |
| C5 | N | C1 | H26 | 40.7° | 40.7° |
| C1 | N | C5 | N2 | 1.4° | 1.4° |
| N | C1 | O | C2 | 110.3° | 110.3° |
| N | C1 | O | C | 118.4° | 118.4° |
| N | C1 | O | H26 | 122.8° | 122.8° |
| N | C1 | C | H26 | 121.5° | 121.5° |
| N | C1 | C | F1 | 156.0° | 156.0° |
| C1 | N | C7 | H3 | 1.0° | 1.0° |
| N | C1 | C | H13 | 30.6° | 30.6° |
| C5 | N2 | C8 | H4 | 179.9° | 179.9° |
| C2 | O | C1 | C | 8.1° | 8.1° |
| O | C2 | C4 | H1 | 177.3° | 177.3° |
| O | C2 | C4 | H2 | 57.7° | 57.7° |
| O | C2 | C3 | H14 | 79.3° | 79.3° |
| C2 | O | C1 | H26 | 126.8° | 126.8° |
| O | C1 | C | H26 | 119.4° | 119.4° |
| O | C1 | C | F1 | 84.9° | 84.9° |
| O | C1 | C | H13 | 149.7° | 149.7° |
| C1 | O | C2 | H20 | 100.4° | 100.4° |
| C1 | C | F1 | H13 | 123.8° | 123.8° |
| C1 | C | C3 | H14 | 75.6° | 75.5° |
| F1 | C | C3 | H14 | 169.9° | 169.9° |
| F1 | C | C1 | H26 | 34.5° | 34.5° |
| H1 | C4 | C2 | H20 | 57.6° | 57.6° |
| H2 | C4 | C2 | H20 | 62.0° | 62.0° |
| H5 | C10 | C13 | H6 | 46.8° | 46.8° |
| H5 | C10 | C11 | H21 | 91.5° | 91.5° |
| H6 | C13 | C12 | H18 | 168.4° | 168.4° |
| H8 | C20 | N9 | H23 | 92.0° | 92.0° |
| H8 | C20 | C23 | H24 | 63.5° | 63.6° |
| H9 | C20 | N9 | H23 | 147.8° | 147.8° |
| H9 | C20 | C23 | H24 | 56.7° | 56.7° |
| H10 | C21 | C22 | H12 | 69.1° | 69.1° |
| H10 | C21 | N4 | H25 | 96.0° | 96.0° |
| H11 | C21 | C22 | H12 | 51.4° | 51.4° |
| H11 | C21 | N4 | H25 | 24.6° | 24.6° |
| H12 | C22 | C23 | H24 | 179.8° | 179.8° |
| H13 | C | C3 | H14 | 43.3° | 43.3° |
| H13 | C | C1 | H26 | 90.9° | 90.9° |
| H14 | C3 | C2 | H20 | 161.7° | 161.7° |
| H16 | C14 | C12 | H18 | 62.2° | 62.2° |
| H17 | C14 | C12 | H18 | 58.7° | 58.7° |
