VWX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O16 | P4 | doub | 1.48Å | 1.51Å | |
| O14 | P4 | sing | 1.61Å | 1.51Å | |
| P4 | O13 | sing | 1.61Å | 1.61Å | |
| P4 | O15 | sing | 1.61Å | 1.51Å | |
| O13 | P3 | sing | 1.61Å | 1.60Å | |
| O12 | P3 | doub | 1.48Å | 1.49Å | |
| P3 | O10 | sing | 1.61Å | 1.60Å | |
| P3 | O11 | sing | 1.61Å | 1.49Å | |
| O10 | P2 | sing | 1.61Å | 1.60Å | |
| O17 | C11 | sing | 1.44Å | 1.45Å | |
| O17 | C13 | sing | 1.44Å | 1.41Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| C12 | O7 | sing | 1.43Å | 1.45Å | |
| C11 | C10 | sing | 1.54Å | 1.54Å | |
| C13 | N6 | sing | 1.46Å | 1.46Å | |
| C13 | C9 | sing | 1.55Å | 1.53Å | |
| C14 | N6 | sing | 1.36Å | 1.37Å | Aromatic |
| C14 | N7 | doub | 1.30Å | 1.31Å | Aromatic |
| O7 | P2 | sing | 1.61Å | 1.61Å | |
| N6 | C18 | sing | 1.37Å | 1.38Å | Aromatic |
| P2 | O8 | doub | 1.48Å | 1.49Å | |
| P2 | O9 | sing | 1.61Å | 1.49Å | |
| N7 | C15 | sing | 1.35Å | 1.39Å | Aromatic |
| O6 | C10 | sing | 1.43Å | 1.42Å | |
| C10 | C9 | sing | 1.55Å | 1.53Å | |
| C18 | C15 | doub | 1.40Å | 1.38Å | Aromatic |
| C18 | N9 | sing | 1.34Å | 1.36Å | |
| C15 | C16 | sing | 1.42Å | 1.43Å | |
| N9 | C17 | doub | 1.30Å | 1.31Å | |
| C9 | O5 | sing | 1.43Å | 1.44Å | |
| C16 | O18 | doub | 1.22Å | 1.23Å | |
| C16 | N8 | sing | 1.35Å | 1.40Å | |
| C17 | N8 | sing | 1.36Å | 1.34Å | |
| O5 | P1 | sing | 1.61Å | 1.61Å | |
| P1 | O4 | doub | 1.48Å | 1.50Å | |
| P1 | O3 | sing | 1.61Å | 1.51Å | |
| P1 | O2 | sing | 1.61Å | 1.61Å | |
| O20 | C20 | sing | 1.43Å | 1.41Å | |
| C20 | C19 | sing | 1.55Å | 1.53Å | |
| C20 | C6 | sing | 1.54Å | 1.52Å | |
| O2 | C8 | sing | 1.43Å | 1.45Å | |
| C19 | O19 | sing | 1.43Å | 1.42Å | |
| C19 | C7 | sing | 1.54Å | 1.54Å | |
| C8 | C7 | sing | 1.53Å | 1.51Å | |
| C5 | N4 | doub | 1.30Å | 1.31Å | Aromatic |
| C5 | N5 | sing | 1.36Å | 1.37Å | Aromatic |
| N4 | C4 | sing | 1.35Å | 1.39Å | Aromatic |
| C7 | O1 | sing | 1.44Å | 1.45Å | |
| N5 | C6 | sing | 1.47Å | 1.45Å | |
| N5 | C3 | sing | 1.37Å | 1.37Å | Aromatic |
| C4 | C1 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C3 | sing | 1.40Å | 1.38Å | Aromatic |
| N1 | C1 | sing | 1.38Å | 1.33Å | |
| C6 | O1 | sing | 1.44Å | 1.41Å | |
| C1 | N2 | sing | 1.33Å | 1.36Å | Aromatic |
| C3 | N3 | doub | 1.33Å | 1.34Å | Aromatic |
| N2 | C2 | doub | 1.32Å | 1.34Å | Aromatic |
| N3 | C2 | sing | 1.32Å | 1.33Å | Aromatic |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C2 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| O3 | H9 | sing | 0.97Å | 0.95Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| O6 | H12 | sing | 0.97Å | 0.95Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| O9 | H16 | sing | 0.97Å | 0.95Å | |
| O11 | H17 | sing | 0.97Å | 0.95Å | |
| O14 | H18 | sing | 0.97Å | 0.95Å | |
| O15 | H19 | sing | 0.97Å | 0.95Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.08Å | 1.08Å | |
| N8 | H22 | sing | 0.97Å | 1.00Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| O19 | H25 | sing | 0.97Å | 0.95Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| O20 | H27 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O16 | P4 | O14 | 113.2° | 109.5° |
| O16 | P4 | O13 | 106.4° | 109.5° |
| O16 | P4 | O15 | 112.5° | 109.5° |
| O14 | P4 | O13 | 105.1° | 109.5° |
| O14 | P4 | O15 | 113.0° | 109.5° |
| P4 | O14 | H18 | 109.5° | 114.0° |
| O13 | P4 | O15 | 105.7° | 109.5° |
| P4 | O13 | P3 | 131.8° | 134.0° |
| P4 | O15 | H19 | 109.5° | 114.0° |
| O13 | P3 | O12 | 108.6° | 109.4° |
| O13 | P3 | O10 | 100.0° | 109.5° |
| O13 | P3 | O11 | 108.2° | 109.5° |
| O12 | P3 | O10 | 109.7° | 109.5° |
| O12 | P3 | O11 | 119.4° | 109.5° |
| O10 | P3 | O11 | 109.1° | 109.5° |
| P3 | O10 | P2 | 132.0° | 134.0° |
| P3 | O11 | H17 | 109.5° | 114.0° |
| O10 | P2 | O7 | 103.0° | 109.5° |
| O10 | P2 | O8 | 108.0° | 109.5° |
| O10 | P2 | O9 | 107.5° | 109.5° |
| C11 | O17 | C13 | 109.4° | 107.0° |
| O17 | C11 | C12 | 109.2° | 110.0° |
| O17 | C11 | C10 | 106.4° | 107.3° |
| O17 | C11 | H13 | 109.0° | 109.9° |
| O17 | C13 | N6 | 108.9° | 110.6° |
| O17 | C13 | C9 | 106.5° | 103.5° |
| O17 | C13 | H20 | 110.1° | 110.6° |
| C11 | C12 | O7 | 110.0° | 109.5° |
| C12 | C11 | C10 | 115.9° | 109.9° |
| C12 | C11 | H13 | 108.2° | 109.9° |
| C11 | C12 | H14 | 109.3° | 109.5° |
| C11 | C12 | H15 | 109.3° | 109.5° |
| C12 | O7 | P2 | 119.6° | 123.0° |
| O7 | C12 | H14 | 109.3° | 109.5° |
| O7 | C12 | H15 | 109.3° | 109.4° |
| C11 | C10 | O6 | 110.6° | 110.6° |
| C11 | C10 | C9 | 105.2° | 104.2° |
| C11 | C10 | H11 | 108.9° | 110.5° |
| C10 | C11 | H13 | 107.9° | 109.9° |
| N6 | C13 | C9 | 113.5° | 110.7° |
| C13 | N6 | C14 | 125.7° | 126.3° |
| C13 | N6 | C18 | 128.3° | 126.3° |
| N6 | C13 | H20 | 109.3° | 110.6° |
| C13 | C9 | C10 | 103.9° | 102.1° |
| C13 | C9 | O5 | 111.6° | 110.9° |
| C13 | C9 | H10 | 109.9° | 110.8° |
| C9 | C13 | H20 | 108.4° | 110.6° |
| N6 | C14 | N7 | 113.4° | 109.8° |
| C14 | N6 | C18 | 105.9° | 107.4° |
| N6 | C14 | H21 | 123.3° | 125.1° |
| C14 | N7 | C15 | 104.3° | 109.3° |
| N7 | C14 | H21 | 123.3° | 125.1° |
| O7 | P2 | O8 | 109.5° | 109.5° |
| O7 | P2 | O9 | 109.0° | 109.4° |
| N6 | C18 | C15 | 106.0° | 106.2° |
| N6 | C18 | N9 | 127.6° | 134.2° |
| O8 | P2 | O9 | 118.7° | 109.5° |
| P2 | O9 | H16 | 109.5° | 114.0° |
| N7 | C15 | C18 | 110.4° | 107.3° |
| N7 | C15 | C16 | 129.9° | 134.3° |
| O6 | C10 | C9 | 112.6° | 110.4° |
| O6 | C10 | H11 | 110.5° | 110.4° |
| C10 | O6 | H12 | 109.5° | 113.9° |
| C10 | C9 | O5 | 110.1° | 111.0° |
| C10 | C9 | H10 | 109.9° | 110.9° |
| C9 | C10 | H11 | 109.0° | 110.5° |
| C15 | C18 | N9 | 126.5° | 119.6° |
| C18 | C15 | C16 | 119.7° | 118.4° |
| C18 | N9 | C17 | 113.0° | 121.2° |
| C15 | C16 | O18 | 127.9° | 121.0° |
| C15 | C16 | N8 | 110.7° | 118.2° |
| N9 | C17 | N8 | 124.8° | 122.2° |
| N9 | C17 | H23 | 117.6° | 118.9° |
| C9 | O5 | P1 | 115.8° | 123.0° |
| O5 | C9 | H10 | 111.2° | 110.8° |
| O18 | C16 | N8 | 121.3° | 120.9° |
| C16 | N8 | C17 | 125.3° | 120.4° |
| C16 | N8 | H22 | 117.4° | 119.8° |
| C17 | N8 | H22 | 117.4° | 119.8° |
| N8 | C17 | H23 | 117.6° | 118.9° |
| O5 | P1 | O4 | 108.7° | 109.5° |
| O5 | P1 | O3 | 109.9° | 109.4° |
| O5 | P1 | O2 | 103.6° | 109.5° |
| O4 | P1 | O3 | 117.4° | 109.5° |
| O4 | P1 | O2 | 106.7° | 109.5° |
| O3 | P1 | O2 | 109.6° | 109.5° |
| P1 | O3 | H9 | 109.5° | 114.0° |
| P1 | O2 | C8 | 120.9° | 123.0° |
| O20 | C20 | C19 | 113.4° | 110.5° |
| O20 | C20 | C6 | 110.4° | 110.5° |
| O20 | C20 | H26 | 111.7° | 110.6° |
| C20 | O20 | H27 | 109.5° | 113.9° |
| C19 | C20 | C6 | 100.7° | 104.1° |
| C20 | C19 | O19 | 108.7° | 110.5° |
| C20 | C19 | C7 | 102.8° | 104.1° |
| C20 | C19 | H24 | 110.4° | 110.7° |
| C19 | C20 | H26 | 110.0° | 110.5° |
| C20 | C6 | N5 | 111.6° | 110.4° |
| C20 | C6 | O1 | 106.3° | 104.8° |
| C20 | C6 | H5 | 109.0° | 110.4° |
| C6 | C20 | H26 | 110.1° | 110.5° |
| O2 | C8 | C7 | 108.4° | 109.5° |
| O2 | C8 | H7 | 109.7° | 109.5° |
| O2 | C8 | H8 | 109.7° | 109.5° |
| O19 | C19 | C7 | 112.1° | 110.5° |
| O19 | C19 | H24 | 112.1° | 110.5° |
| C19 | O19 | H25 | 109.5° | 114.0° |
| C19 | C7 | C8 | 115.8° | 110.5° |
| C19 | C7 | O1 | 105.5° | 104.8° |
| C19 | C7 | H6 | 108.4° | 110.4° |
| C7 | C19 | H24 | 110.3° | 110.5° |
| C8 | C7 | O1 | 108.7° | 110.4° |
| C8 | C7 | H6 | 108.7° | 110.3° |
| C7 | C8 | H7 | 109.7° | 109.5° |
| C7 | C8 | H8 | 109.7° | 109.4° |
| N4 | C5 | N5 | 112.4° | 110.0° |
| C5 | N4 | C4 | 104.8° | 109.4° |
| N4 | C5 | H4 | 123.8° | 125.0° |
| C5 | N5 | C6 | 127.2° | 126.3° |
| C5 | N5 | C3 | 106.8° | 107.4° |
| N5 | C5 | H4 | 123.8° | 125.0° |
| N4 | C4 | C1 | 132.5° | 134.7° |
| N4 | C4 | C3 | 110.2° | 107.2° |
| C7 | O1 | C6 | 110.0° | 105.3° |
| O1 | C7 | H6 | 109.5° | 110.4° |
| C6 | N5 | C3 | 125.9° | 126.3° |
| N5 | C6 | O1 | 109.4° | 110.4° |
| N5 | C6 | H5 | 110.0° | 110.3° |
| N5 | C3 | C4 | 105.7° | 106.0° |
| N5 | C3 | N3 | 127.4° | 134.9° |
| C1 | C4 | C3 | 117.3° | 118.2° |
| C4 | C1 | N1 | 123.4° | 120.8° |
| C4 | C1 | N2 | 117.3° | 118.4° |
| C4 | C3 | N3 | 126.9° | 119.1° |
| N1 | C1 | N2 | 119.3° | 120.7° |
| C1 | N1 | H1 | 109.5° | 120.0° |
| C1 | N1 | H2 | 109.5° | 120.0° |
| O1 | C6 | H5 | 110.5° | 110.3° |
| C1 | N2 | C2 | 118.6° | 121.2° |
| C3 | N3 | C2 | 110.7° | 120.6° |
| N2 | C2 | N3 | 129.1° | 122.4° |
| N2 | C2 | H3 | 115.5° | 118.8° |
| N3 | C2 | H3 | 115.4° | 118.8° |
| H1 | N1 | H2 | 109.5° | 120.0° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H14 | C12 | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O16 | P4 | O14 | O13 | 115.8° | 120.0° |
| O16 | P4 | O14 | O15 | 129.4° | 120.0° |
| O16 | P4 | O13 | O15 | 119.8° | 120.0° |
| O16 | P4 | O13 | P3 | 139.6° | 45.0° |
| O16 | P4 | O14 | H18 | 0.0° | 60.0° |
| O16 | P4 | O15 | H19 | 0.0° | 180.0° |
| O14 | P4 | O13 | O15 | 119.8° | 120.0° |
| O14 | P4 | O13 | P3 | 100.0° | 165.0° |
| O14 | P4 | O15 | H19 | 129.8° | 60.0° |
| P4 | O13 | P3 | O12 | 170.6° | 40.0° |
| P4 | O13 | P3 | O10 | 55.7° | 160.0° |
| P4 | O13 | P3 | O11 | 58.4° | 80.0° |
| O13 | P4 | O14 | H18 | 115.8° | 180.0° |
| O13 | P4 | O15 | H19 | 115.8° | 60.0° |
| O15 | P4 | O13 | P3 | 19.8° | 75.0° |
| O15 | P4 | O14 | H18 | 129.4° | 60.0° |
| O13 | P3 | O12 | O10 | 108.4° | 120.0° |
| O13 | P3 | O12 | O11 | 124.6° | 120.0° |
| O13 | P3 | O10 | O11 | 113.4° | 120.0° |
| O13 | P3 | O10 | P2 | 137.2° | 165.0° |
| O13 | P3 | O11 | H17 | 124.8° | 60.0° |
| O12 | P3 | O10 | O11 | 132.6° | 120.0° |
| O12 | P3 | O10 | P2 | 108.8° | 45.1° |
| O12 | P3 | O11 | H17 | 0.0° | 180.0° |
| P3 | O10 | P2 | O7 | 160.0° | 165.0° |
| P3 | O10 | P2 | O8 | 84.3° | 45.0° |
| P3 | O10 | P2 | O9 | 45.0° | 75.1° |
| O10 | P3 | O11 | H17 | 127.3° | 60.0° |
| O11 | P3 | O10 | P2 | 23.8° | 74.9° |
| O10 | P2 | O7 | C12 | 48.8° | 175.0° |
| O10 | P2 | O7 | O8 | 114.7° | 120.0° |
| O10 | P2 | O7 | O9 | 113.9° | 120.0° |
| O10 | P2 | O8 | O9 | 122.6° | 120.0° |
| O10 | P2 | O9 | H16 | 122.8° | 60.0° |
| O17 | C11 | C12 | C10 | 120.1° | 117.9° |
| O17 | C11 | C12 | H13 | 118.6° | 121.1° |
| O17 | C11 | C12 | O7 | 66.2° | 67.1° |
| O17 | C11 | C10 | H13 | 116.9° | 119.4° |
| C11 | O17 | C13 | N6 | 152.9° | 158.6° |
| C11 | O17 | C13 | C9 | 30.2° | 40.0° |
| O17 | C11 | C10 | O6 | 123.6° | 120.8° |
| O17 | C11 | C10 | C9 | 1.8° | 2.1° |
| O17 | C11 | C10 | H11 | 114.9° | 116.7° |
| O17 | C11 | C12 | H14 | 53.9° | 172.9° |
| O17 | C11 | C12 | H15 | 173.7° | 52.9° |
| C11 | O17 | C13 | H20 | 87.2° | 78.6° |
| C13 | O17 | C11 | C12 | 145.8° | 145.9° |
| C13 | O17 | C11 | C10 | 20.0° | 26.5° |
| O17 | C13 | N6 | C9 | 118.4° | 114.1° |
| O17 | C13 | N6 | H20 | 120.4° | 122.9° |
| O17 | C13 | C9 | H20 | 118.5° | 118.5° |
| O17 | C13 | N6 | C14 | 131.9° | 23.9° |
| O17 | C13 | N6 | C18 | 49.0° | 156.4° |
| O17 | C13 | C9 | C10 | 27.6° | 36.9° |
| O17 | C13 | C9 | O5 | 146.2° | 155.2° |
| O17 | C13 | C9 | H10 | 89.9° | 81.2° |
| C13 | O17 | C11 | H13 | 96.1° | 93.0° |
| C11 | C12 | O7 | H14 | 120.1° | 120.0° |
| C11 | C12 | O7 | H15 | 120.1° | 120.0° |
| C12 | C11 | C10 | H13 | 121.5° | 121.0° |
| C11 | C12 | O7 | P2 | 170.3° | 180.0° |
| C12 | C11 | C10 | O6 | 114.8° | 119.7° |
| C12 | C11 | C10 | C9 | 123.4° | 121.6° |
| C12 | C11 | C10 | H11 | 6.8° | 2.9° |
| C11 | C12 | H14 | H15 | 119.7° | 120.1° |
| O7 | C12 | C11 | C10 | 54.0° | 175.0° |
| C12 | O7 | P2 | O8 | 65.9° | 55.0° |
| C12 | O7 | P2 | O9 | 162.7° | 65.0° |
| O7 | C12 | C11 | H13 | 175.3° | 54.0° |
| O7 | C12 | H14 | H15 | 119.7° | 119.9° |
| C11 | C10 | C9 | C13 | 15.1° | 20.8° |
| C11 | C10 | O6 | C9 | 117.3° | 114.8° |
| C11 | C10 | O6 | H11 | 120.6° | 122.6° |
| C11 | C10 | C9 | H11 | 116.6° | 118.7° |
| C11 | C10 | C9 | O5 | 134.7° | 139.1° |
| C11 | C10 | C9 | H10 | 102.5° | 97.3° |
| C11 | C10 | O6 | H12 | 180.0° | 65.2° |
| C10 | C11 | C12 | H14 | 174.0° | 55.0° |
| C10 | C11 | C12 | H15 | 66.1° | 65.0° |
| N6 | C13 | C9 | H20 | 121.7° | 122.9° |
| C13 | N6 | C14 | C18 | 179.2° | 179.8° |
| C13 | N6 | C14 | N7 | 179.5° | 180.0° |
| N6 | C13 | C9 | C10 | 147.5° | 155.5° |
| C13 | N6 | C18 | C15 | 179.6° | 179.9° |
| C13 | N6 | C18 | N9 | 0.6° | 0.7° |
| N6 | C13 | C9 | O5 | 93.9° | 86.2° |
| N6 | C13 | C9 | H10 | 30.0° | 37.3° |
| C13 | N6 | C14 | H21 | 0.5° | 0.0° |
| C9 | C13 | N6 | C14 | 109.7° | 90.3° |
| C9 | C13 | N6 | C18 | 69.4° | 89.4° |
| C13 | C9 | C10 | O6 | 105.4° | 98.0° |
| C13 | C9 | C10 | O5 | 119.6° | 118.3° |
| C13 | C9 | C10 | H10 | 117.5° | 118.1° |
| C13 | C9 | O5 | H10 | 123.1° | 123.6° |
| C13 | C9 | O5 | P1 | 129.0° | 122.9° |
| C13 | C9 | C10 | H11 | 131.6° | 139.5° |
| N6 | C14 | N7 | H21 | 180.0° | 180.0° |
| N6 | C14 | N7 | C15 | 0.0° | 0.0° |
| C14 | N6 | C18 | C15 | 0.4° | 0.3° |
| C14 | N6 | C18 | N9 | 179.8° | 179.5° |
| C14 | N6 | C13 | H20 | 11.6° | 146.7° |
| N7 | C14 | N6 | C18 | 0.3° | 0.2° |
| C14 | N7 | C15 | C18 | 0.2° | 0.3° |
| C14 | N7 | C15 | C16 | 179.9° | 180.0° |
| O7 | P2 | O8 | O9 | 126.0° | 120.0° |
| P2 | O7 | C12 | H14 | 69.6° | 60.0° |
| P2 | O7 | C12 | H15 | 50.2° | 60.0° |
| O7 | P2 | O9 | H16 | 126.2° | 60.0° |
| N6 | C18 | C15 | N7 | 0.4° | 0.4° |
| N6 | C18 | C15 | N9 | 179.8° | 179.3° |
| N6 | C18 | C15 | C16 | 179.9° | 179.9° |
| N6 | C18 | N9 | C17 | 179.8° | 179.6° |
| C18 | N6 | C13 | H20 | 169.4° | 33.5° |
| C18 | N6 | C14 | H21 | 179.8° | 179.8° |
| O8 | P2 | O9 | H16 | 0.0° | 180.0° |
| N7 | C15 | C18 | C16 | 179.7° | 179.8° |
| N7 | C15 | C18 | N9 | 179.8° | 179.7° |
| N7 | C15 | C16 | O18 | 0.3° | 0.0° |
| N7 | C15 | C16 | N8 | 179.8° | 180.0° |
| C15 | N7 | C14 | H21 | 180.0° | 180.0° |
| O6 | C10 | C9 | H11 | 122.9° | 122.5° |
| O6 | C10 | C9 | O5 | 14.2° | 20.3° |
| O6 | C10 | C9 | H10 | 137.0° | 143.9° |
| O6 | C10 | C11 | H13 | 6.7° | 1.3° |
| C10 | C9 | O5 | H10 | 122.0° | 123.6° |
| C10 | C9 | O5 | P1 | 116.2° | 124.3° |
| C9 | C10 | O6 | H12 | 62.7° | 180.0° |
| C9 | C10 | C11 | H13 | 115.1° | 117.4° |
| C10 | C9 | C13 | H20 | 90.8° | 81.6° |
| C15 | C18 | N9 | C17 | 0.1° | 0.5° |
| C18 | C15 | C16 | O18 | 179.9° | 179.7° |
| C18 | C15 | C16 | N8 | 0.1° | 0.3° |
| N9 | C18 | C15 | C16 | 0.1° | 0.5° |
| C18 | N9 | C17 | N8 | 0.0° | 0.2° |
| C18 | N9 | C17 | H23 | 180.0° | 179.7° |
| C15 | C16 | O18 | N8 | 179.9° | 180.0° |
| C15 | C16 | N8 | C17 | 0.1° | 0.0° |
| C15 | C16 | N8 | H22 | 179.9° | 179.9° |
| N9 | C17 | N8 | C16 | 0.0° | 0.1° |
| N9 | C17 | N8 | H23 | 180.0° | 179.9° |
| N9 | C17 | N8 | H22 | 180.0° | 180.0° |
| C9 | O5 | P1 | O4 | 83.5° | 55.0° |
| C9 | O5 | P1 | O3 | 146.8° | 65.0° |
| C9 | O5 | P1 | O2 | 29.7° | 175.0° |
| O5 | C9 | C10 | H11 | 108.7° | 102.2° |
| O5 | C9 | C13 | H20 | 27.8° | 36.7° |
| O18 | C16 | N8 | C17 | 180.0° | 180.0° |
| O18 | C16 | N8 | H22 | 0.0° | 0.1° |
| C16 | N8 | C17 | H22 | 180.0° | 179.9° |
| C16 | N8 | C17 | H23 | 179.9° | 180.0° |
| O5 | P1 | O4 | O3 | 125.5° | 119.9° |
| O5 | P1 | O4 | O2 | 111.2° | 120.0° |
| O5 | P1 | O3 | O2 | 113.2° | 120.0° |
| O5 | P1 | O2 | C8 | 92.0° | 175.0° |
| O5 | P1 | O3 | H9 | 124.9° | 60.0° |
| P1 | O5 | C9 | H10 | 5.8° | 0.6° |
| O4 | P1 | O3 | O2 | 121.9° | 120.0° |
| O4 | P1 | O2 | C8 | 153.3° | 55.0° |
| O4 | P1 | O3 | H9 | 0.0° | 180.0° |
| O3 | P1 | O2 | C8 | 25.2° | 65.1° |
| P1 | O2 | C8 | C7 | 175.8° | 180.0° |
| P1 | O2 | C8 | H7 | 64.3° | 59.9° |
| P1 | O2 | C8 | H8 | 56.0° | 60.0° |
| O2 | P1 | O3 | H9 | 121.9° | 59.9° |
| O20 | C20 | C19 | C6 | 117.9° | 118.7° |
| O20 | C20 | C19 | H26 | 125.9° | 122.8° |
| O20 | C20 | C6 | H26 | 123.8° | 122.8° |
| O20 | C20 | C19 | O19 | 35.1° | 0.0° |
| O20 | C20 | C19 | C7 | 154.1° | 118.6° |
| O20 | C20 | C6 | N5 | 84.4° | 98.5° |
| O20 | C20 | C6 | O1 | 156.3° | 142.6° |
| O20 | C20 | C6 | H5 | 37.2° | 23.8° |
| O20 | C20 | C19 | H24 | 88.2° | 122.7° |
| C19 | C20 | C6 | H26 | 116.1° | 118.6° |
| C20 | C19 | O19 | C7 | 113.0° | 114.6° |
| C20 | C19 | O19 | H24 | 122.3° | 122.8° |
| C20 | C19 | C7 | H24 | 117.8° | 118.8° |
| C20 | C19 | C7 | C8 | 95.5° | 142.9° |
| C20 | C19 | C7 | O1 | 24.7° | 24.0° |
| C19 | C20 | C6 | N5 | 155.5° | 142.8° |
| C19 | C20 | C6 | O1 | 36.2° | 23.9° |
| C19 | C20 | C6 | H5 | 82.9° | 94.9° |
| C20 | C19 | C7 | H6 | 142.0° | 94.8° |
| C20 | C19 | O19 | H25 | 180.0° | 65.4° |
| C19 | C20 | O20 | H27 | 180.0° | 61.4° |
| C6 | C20 | C19 | O19 | 82.8° | 118.6° |
| C6 | C20 | C19 | C7 | 36.1° | 0.0° |
| C20 | C6 | N5 | C5 | 83.2° | 91.9° |
| C20 | C6 | O1 | C7 | 21.8° | 40.5° |
| C20 | C6 | N5 | O1 | 117.3° | 115.4° |
| C20 | C6 | N5 | H5 | 121.1° | 122.4° |
| C20 | C6 | N5 | C3 | 93.9° | 87.3° |
| C20 | C6 | O1 | H5 | 118.1° | 118.9° |
| C6 | C20 | C19 | H24 | 153.8° | 118.7° |
| C6 | C20 | O20 | H27 | 67.9° | 176.1° |
| O2 | C8 | C7 | C19 | 80.1° | 178.1° |
| O2 | C8 | C7 | H7 | 119.8° | 120.0° |
| O2 | C8 | C7 | H8 | 119.9° | 120.0° |
| O2 | C8 | C7 | O1 | 38.3° | 66.4° |
| O2 | C8 | C7 | H6 | 157.5° | 55.8° |
| O2 | C8 | H7 | H8 | 120.5° | 120.0° |
| O19 | C19 | C7 | H24 | 125.7° | 122.5° |
| O19 | C19 | C7 | C8 | 148.0° | 98.5° |
| O19 | C19 | C7 | O1 | 91.8° | 142.6° |
| O19 | C19 | C7 | H6 | 25.4° | 23.8° |
| O19 | C19 | C20 | H26 | 161.0° | 122.8° |
| C19 | C7 | C8 | O1 | 118.5° | 115.4° |
| C19 | C7 | C8 | H6 | 122.4° | 122.4° |
| C19 | C7 | O1 | H6 | 116.5° | 118.8° |
| C19 | C7 | O1 | C6 | 2.1° | 40.5° |
| C19 | C7 | C8 | H7 | 39.7° | 58.1° |
| C19 | C7 | C8 | H8 | 160.0° | 61.9° |
| C7 | C19 | O19 | H25 | 67.0° | 180.0° |
| C7 | C19 | C20 | H26 | 80.0° | 118.6° |
| C8 | C7 | O1 | H6 | 118.7° | 122.2° |
| C8 | C7 | O1 | C6 | 122.7° | 159.5° |
| C7 | C8 | H7 | H8 | 120.5° | 120.0° |
| C8 | C7 | C19 | H24 | 22.3° | 24.1° |
| N4 | C5 | N5 | H4 | 180.0° | 179.4° |
| N4 | C5 | N5 | C6 | 178.7° | 180.0° |
| N4 | C5 | N5 | C3 | 1.2° | 0.7° |
| C5 | N4 | C4 | C1 | 179.8° | 180.0° |
| C5 | N4 | C4 | C3 | 0.2° | 0.2° |
| N5 | C5 | N4 | C4 | 0.9° | 0.6° |
| C5 | N5 | C6 | C3 | 177.0° | 179.2° |
| C5 | N5 | C3 | C4 | 1.0° | 0.5° |
| C5 | N5 | C6 | O1 | 34.2° | 23.5° |
| C5 | N5 | C3 | N3 | 179.6° | 179.2° |
| C5 | N5 | C6 | H5 | 155.8° | 145.8° |
| N4 | C4 | C3 | N5 | 0.5° | 0.2° |
| N4 | C4 | C1 | C3 | 180.0° | 179.7° |
| N4 | C4 | C1 | N1 | 0.1° | 0.0° |
| N4 | C4 | C1 | N2 | 179.8° | 179.7° |
| N4 | C4 | C3 | N3 | 179.9° | 179.6° |
| C4 | N4 | C5 | H4 | 179.1° | 179.9° |
| C7 | O1 | C6 | N5 | 142.4° | 159.4° |
| C7 | O1 | C6 | H5 | 96.4° | 78.4° |
| O1 | C7 | C8 | H7 | 158.2° | 173.5° |
| O1 | C7 | C8 | H8 | 81.5° | 53.6° |
| O1 | C7 | C19 | H24 | 142.5° | 94.8° |
| C6 | N5 | C3 | C4 | 178.5° | 179.8° |
| N5 | C6 | O1 | H5 | 121.3° | 122.2° |
| C6 | N5 | C3 | N3 | 2.1° | 0.1° |
| C6 | N5 | C5 | H4 | 1.3° | 0.6° |
| N5 | C6 | C20 | H26 | 39.4° | 24.2° |
| N5 | C3 | C4 | C1 | 179.5° | 179.6° |
| N5 | C3 | C4 | N3 | 179.4° | 179.8° |
| C3 | N5 | C6 | O1 | 148.8° | 157.3° |
| N5 | C3 | N3 | C2 | 179.2° | 180.0° |
| C3 | N5 | C5 | H4 | 178.8° | 180.0° |
| C3 | N5 | C6 | H5 | 27.2° | 35.0° |
| C4 | C1 | N1 | N2 | 180.0° | 179.6° |
| C1 | C4 | C3 | N3 | 0.1° | 0.6° |
| C4 | C1 | N2 | C2 | 0.0° | 0.4° |
| C4 | C1 | N1 | H1 | 180.0° | 179.7° |
| C4 | C1 | N1 | H2 | 59.9° | 0.6° |
| C3 | C4 | C1 | N1 | 179.9° | 179.8° |
| C3 | C4 | C1 | N2 | 0.1° | 0.6° |
| C4 | C3 | N3 | C2 | 0.1° | 0.3° |
| N1 | C1 | N2 | C2 | 180.0° | 180.0° |
| C1 | N1 | H1 | H2 | 120.0° | 179.7° |
| C6 | O1 | C7 | H6 | 118.6° | 78.3° |
| O1 | C6 | C20 | H26 | 79.8° | 94.6° |
| C1 | N2 | C2 | N3 | 0.1° | 0.1° |
| N2 | C1 | N1 | H1 | 0.0° | 0.1° |
| N2 | C1 | N1 | H2 | 120.0° | 179.8° |
| C1 | N2 | C2 | H3 | 179.8° | 180.0° |
| C3 | N3 | C2 | N2 | 0.2° | 0.1° |
| C3 | N3 | C2 | H3 | 179.8° | 180.0° |
| N2 | C2 | N3 | H3 | 180.0° | 179.9° |
| H5 | C6 | C20 | H26 | 161.0° | 146.6° |
| H6 | C7 | C8 | H7 | 82.6° | 64.3° |
| H6 | C7 | C8 | H8 | 37.7° | 175.8° |
| H6 | C7 | C19 | H24 | 100.2° | 146.4° |
| H10 | C9 | C10 | H11 | 14.1° | 21.4° |
| H10 | C9 | C13 | H20 | 151.7° | 160.3° |
| H11 | C10 | O6 | H12 | 59.4° | 57.4° |
| H11 | C10 | C11 | H13 | 128.2° | 123.9° |
| H13 | C11 | C12 | H14 | 64.7° | 66.0° |
| H13 | C11 | C12 | H15 | 55.2° | 174.0° |
| H22 | N8 | C17 | H23 | 0.1° | 0.1° |
| H24 | C19 | O19 | H25 | 57.7° | 57.4° |
| H24 | C19 | C20 | H26 | 37.7° | 0.1° |
| H26 | C20 | O20 | H27 | 55.0° | 61.2° |
