A1C9A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C4 | sing | 1.43Å | 1.41Å | |
| C4 | C13 | sing | 1.54Å | 1.52Å | |
| C4 | C7 | sing | 1.55Å | 1.52Å | |
| C13 | C5 | sing | 1.53Å | 1.53Å | |
| C13 | O3 | sing | 1.44Å | 1.41Å | |
| C5 | O1 | sing | 1.43Å | 1.41Å | |
| O1 | P1 | sing | 1.61Å | 1.69Å | |
| O12 | P1 | doub | 1.48Å | 1.50Å | |
| O5 | C7 | sing | 1.43Å | 1.42Å | |
| O3 | C6 | sing | 1.44Å | 1.39Å | |
| C7 | C6 | sing | 1.55Å | 1.54Å | |
| O13 | P1 | sing | 1.61Å | 1.51Å | |
| P1 | O2 | sing | 1.61Å | 1.69Å | |
| C6 | N10 | sing | 1.46Å | 1.52Å | |
| O2 | P2 | sing | 1.61Å | 1.68Å | |
| N10 | C30 | doub | 1.32Å | 1.36Å | Aromatic |
| N10 | C31 | sing | 1.32Å | 1.36Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| O11 | P2 | doub | 1.48Å | 1.51Å | |
| P2 | O7 | sing | 1.61Å | 1.74Å | |
| P2 | O6 | sing | 1.61Å | 1.51Å | |
| O7 | C2 | sing | 1.43Å | 1.43Å | |
| C29 | C28 | doub | 1.40Å | 1.40Å | Aromatic |
| C32 | C28 | sing | 1.40Å | 1.40Å | Aromatic |
| C28 | C27 | sing | 1.48Å | 1.49Å | |
| C14 | O10 | sing | 1.43Å | 1.42Å | |
| C14 | C1 | sing | 1.55Å | 1.53Å | |
| C14 | C3 | sing | 1.54Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.56Å | |
| O9 | C1 | sing | 1.43Å | 1.43Å | |
| C1 | C15 | sing | 1.55Å | 1.53Å | |
| C3 | O8 | sing | 1.44Å | 1.43Å | |
| C27 | C33 | doub | 1.37Å | 1.40Å | Aromatic |
| C27 | N9 | sing | 1.34Å | 1.32Å | Aromatic |
| C8 | N3 | sing | 1.36Å | 1.35Å | Aromatic |
| C8 | N1 | doub | 1.30Å | 1.31Å | Aromatic |
| C33 | N8 | sing | 1.36Å | 1.37Å | Aromatic |
| C15 | O8 | sing | 1.44Å | 1.40Å | |
| C15 | N3 | sing | 1.47Å | 1.51Å | |
| N9 | C26 | doub | 1.32Å | 1.35Å | Aromatic |
| N3 | C10 | sing | 1.37Å | 1.37Å | Aromatic |
| N1 | C9 | sing | 1.35Å | 1.35Å | Aromatic |
| C26 | N8 | sing | 1.37Å | 1.40Å | Aromatic |
| C26 | C24 | sing | 1.41Å | 1.39Å | Aromatic |
| N8 | C25 | sing | 1.37Å | 1.37Å | Aromatic |
| C10 | C9 | doub | 1.41Å | 1.38Å | Aromatic |
| C10 | N4 | sing | 1.33Å | 1.36Å | Aromatic |
| C9 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| C25 | C23 | doub | 1.36Å | 1.40Å | Aromatic |
| C24 | N7 | doub | 1.31Å | 1.35Å | Aromatic |
| N4 | C11 | doub | 1.32Å | 1.34Å | Aromatic |
| C12 | N5 | sing | 1.38Å | 1.38Å | |
| C12 | N2 | doub | 1.33Å | 1.35Å | Aromatic |
| C11 | N2 | sing | 1.32Å | 1.34Å | Aromatic |
| C23 | N7 | sing | 1.34Å | 1.35Å | Aromatic |
| C23 | C22 | sing | 1.48Å | 1.47Å | |
| C22 | C34 | doub | 1.36Å | 1.38Å | Aromatic |
| C22 | N6 | sing | 1.38Å | 1.37Å | Aromatic |
| C34 | C18 | sing | 1.46Å | 1.43Å | Aromatic |
| N6 | C19 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C19 | doub | 1.41Å | 1.43Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | F1 | sing | 1.35Å | 1.34Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.08Å | 1.08Å | |
| C21 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H12 | sing | 1.08Å | 1.08Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C2 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| N5 | H19 | sing | 0.97Å | 1.00Å | |
| N5 | H20 | sing | 0.97Å | 1.00Å | |
| O4 | H21 | sing | 0.97Å | 0.95Å | |
| O5 | H22 | sing | 0.97Å | 0.95Å | |
| O6 | H23 | sing | 0.97Å | 0.95Å | |
| O9 | H24 | sing | 0.97Å | 0.95Å | |
| O10 | H25 | sing | 0.97Å | 0.95Å | |
| O13 | H26 | sing | 0.97Å | 0.95Å | |
| N6 | H27 | sing | 0.97Å | 1.00Å | |
| C25 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C4 | C13 | 112.7° | 110.5° |
| O4 | C4 | C7 | 113.6° | 110.5° |
| O4 | C4 | H1 | 109.4° | 110.5° |
| C4 | O4 | H21 | 109.5° | 114.0° |
| C13 | C4 | C7 | 104.8° | 104.2° |
| C4 | C13 | C5 | 117.0° | 109.9° |
| C4 | C13 | O3 | 105.6° | 107.3° |
| C13 | C4 | H1 | 108.0° | 110.5° |
| C4 | C13 | H7 | 108.9° | 109.9° |
| C4 | C7 | O5 | 118.0° | 110.9° |
| C4 | C7 | C6 | 104.0° | 102.1° |
| C7 | C4 | H1 | 108.0° | 110.5° |
| C4 | C7 | H5 | 107.6° | 110.9° |
| C5 | C13 | O3 | 106.1° | 109.9° |
| C13 | C5 | O1 | 105.2° | 109.5° |
| C13 | C5 | H2 | 110.5° | 109.5° |
| C13 | C5 | H3 | 110.6° | 109.4° |
| C5 | C13 | H7 | 108.7° | 109.9° |
| C13 | O3 | C6 | 112.7° | 107.0° |
| O3 | C13 | H7 | 110.4° | 110.0° |
| C5 | O1 | P1 | 117.3° | 123.0° |
| O1 | C5 | H2 | 110.5° | 109.4° |
| O1 | C5 | H3 | 110.5° | 109.5° |
| O1 | P1 | O12 | 108.7° | 109.5° |
| O1 | P1 | O13 | 109.5° | 109.5° |
| O1 | P1 | O2 | 96.0° | 109.5° |
| O12 | P1 | O13 | 122.3° | 109.5° |
| O12 | P1 | O2 | 109.5° | 109.5° |
| O5 | C7 | C6 | 110.3° | 110.9° |
| O5 | C7 | H5 | 108.9° | 110.9° |
| C7 | O5 | H22 | 109.5° | 114.0° |
| O3 | C6 | C7 | 107.3° | 103.5° |
| O3 | C6 | N10 | 111.5° | 110.6° |
| O3 | C6 | H4 | 108.8° | 110.8° |
| C7 | C6 | N10 | 114.8° | 110.6° |
| C7 | C6 | H4 | 107.0° | 110.6° |
| C6 | C7 | H5 | 107.4° | 110.9° |
| O13 | P1 | O2 | 107.7° | 109.5° |
| P1 | O13 | H26 | 109.5° | 114.0° |
| P1 | O2 | P2 | 137.5° | 134.0° |
| C6 | N10 | C30 | 120.5° | 119.0° |
| C6 | N10 | C31 | 118.0° | 119.0° |
| N10 | C6 | H4 | 107.2° | 110.6° |
| O2 | P2 | O11 | 108.2° | 109.5° |
| O2 | P2 | O7 | 96.9° | 109.5° |
| O2 | P2 | O6 | 107.7° | 109.5° |
| C30 | N10 | C31 | 121.5° | 122.0° |
| N10 | C30 | C29 | 120.3° | 120.9° |
| N10 | C30 | H30 | 119.9° | 119.5° |
| N10 | C31 | C32 | 119.8° | 120.9° |
| N10 | C31 | H31 | 120.1° | 119.5° |
| C30 | C29 | C28 | 119.7° | 119.0° |
| C30 | C29 | H29 | 120.2° | 120.5° |
| C29 | C30 | H30 | 119.9° | 119.6° |
| C31 | C32 | C28 | 120.3° | 119.0° |
| C32 | C31 | H31 | 120.1° | 119.6° |
| C31 | C32 | H32 | 119.8° | 120.5° |
| O11 | P2 | O7 | 108.4° | 109.4° |
| O11 | P2 | O6 | 123.7° | 109.4° |
| O7 | P2 | O6 | 108.7° | 109.5° |
| P2 | O7 | C2 | 118.0° | 123.0° |
| P2 | O6 | H23 | 109.5° | 113.9° |
| O7 | C2 | C3 | 114.1° | 109.5° |
| O7 | C2 | H14 | 108.3° | 109.5° |
| O7 | C2 | H15 | 108.3° | 109.5° |
| C29 | C28 | C32 | 118.5° | 118.2° |
| C29 | C28 | C27 | 120.9° | 120.9° |
| C28 | C29 | H29 | 120.2° | 120.5° |
| C32 | C28 | C27 | 120.6° | 121.0° |
| C28 | C32 | H32 | 119.9° | 120.5° |
| C28 | C27 | C33 | 128.6° | 125.8° |
| C28 | C27 | N9 | 119.2° | 125.9° |
| O10 | C14 | C1 | 109.8° | 110.5° |
| O10 | C14 | C3 | 113.2° | 110.6° |
| O10 | C14 | H18 | 110.1° | 110.4° |
| C14 | O10 | H25 | 109.5° | 114.0° |
| C1 | C14 | C3 | 106.4° | 104.0° |
| C14 | C1 | O9 | 115.5° | 110.6° |
| C14 | C1 | C15 | 100.5° | 104.1° |
| C14 | C1 | H13 | 109.4° | 110.5° |
| C1 | C14 | H18 | 108.7° | 110.5° |
| C14 | C3 | C2 | 118.1° | 110.4° |
| C14 | C3 | O8 | 102.5° | 104.9° |
| C14 | C3 | H16 | 108.8° | 110.5° |
| C3 | C14 | H18 | 108.5° | 110.7° |
| C2 | C3 | O8 | 108.5° | 110.4° |
| C3 | C2 | H14 | 108.3° | 109.5° |
| C3 | C2 | H15 | 108.3° | 109.4° |
| C2 | C3 | H16 | 108.5° | 110.3° |
| O9 | C1 | C15 | 110.7° | 110.5° |
| O9 | C1 | H13 | 110.8° | 110.5° |
| C1 | O9 | H24 | 109.5° | 114.0° |
| C1 | C15 | O8 | 108.7° | 104.8° |
| C1 | C15 | N3 | 115.3° | 110.4° |
| C1 | C15 | H8 | 106.5° | 110.5° |
| C15 | C1 | H13 | 109.4° | 110.5° |
| C3 | O8 | C15 | 113.0° | 105.2° |
| O8 | C3 | H16 | 110.3° | 110.4° |
| C33 | C27 | N9 | 112.2° | 108.3° |
| C27 | C33 | N8 | 105.7° | 107.0° |
| C27 | C33 | H33 | 127.2° | 126.5° |
| C27 | N9 | C26 | 105.1° | 109.1° |
| N3 | C8 | N1 | 113.9° | 110.0° |
| C8 | N3 | C15 | 128.2° | 126.3° |
| C8 | N3 | C10 | 106.0° | 107.5° |
| N3 | C8 | H6 | 123.0° | 125.1° |
| C8 | N1 | C9 | 103.7° | 109.4° |
| N1 | C8 | H6 | 123.1° | 125.0° |
| C33 | N8 | C26 | 105.1° | 107.4° |
| C33 | N8 | C25 | 133.4° | 133.3° |
| N8 | C33 | H33 | 127.2° | 126.5° |
| O8 | C15 | N3 | 111.4° | 110.3° |
| O8 | C15 | H8 | 108.0° | 110.4° |
| C15 | N3 | C10 | 125.6° | 126.2° |
| N3 | C15 | H8 | 106.6° | 110.3° |
| N9 | C26 | N8 | 111.9° | 108.2° |
| N9 | C26 | C24 | 130.6° | 132.8° |
| N3 | C10 | C9 | 104.8° | 106.0° |
| N3 | C10 | N4 | 128.7° | 135.0° |
| N1 | C9 | C10 | 111.6° | 107.1° |
| N1 | C9 | C12 | 132.6° | 134.7° |
| N8 | C26 | C24 | 117.4° | 118.9° |
| C26 | N8 | C25 | 121.5° | 119.3° |
| C26 | C24 | N7 | 122.2° | 119.9° |
| C26 | C24 | H12 | 118.9° | 120.1° |
| N8 | C25 | C23 | 117.5° | 119.6° |
| N8 | C25 | H28 | 121.3° | 120.2° |
| C9 | C10 | N4 | 126.5° | 119.1° |
| C10 | C9 | C12 | 115.8° | 118.2° |
| C10 | N4 | C11 | 111.4° | 120.7° |
| C9 | C12 | N5 | 124.2° | 120.7° |
| C9 | C12 | N2 | 119.7° | 118.5° |
| C25 | C23 | N7 | 122.5° | 121.0° |
| C25 | C23 | C22 | 123.0° | 119.5° |
| C23 | C25 | H28 | 121.3° | 120.2° |
| C24 | N7 | C23 | 118.9° | 121.3° |
| N7 | C24 | H12 | 118.9° | 120.0° |
| N4 | C11 | N2 | 129.1° | 122.4° |
| N4 | C11 | H17 | 115.5° | 118.8° |
| N5 | C12 | N2 | 116.1° | 120.8° |
| C12 | N5 | H19 | 109.5° | 120.0° |
| C12 | N5 | H20 | 109.5° | 120.0° |
| C12 | N2 | C11 | 117.4° | 121.2° |
| N2 | C11 | H17 | 115.4° | 118.7° |
| N7 | C23 | C22 | 114.5° | 119.6° |
| C23 | C22 | C34 | 130.6° | 125.2° |
| C23 | C22 | N6 | 122.0° | 125.3° |
| C34 | C22 | N6 | 107.5° | 109.5° |
| C22 | C34 | C18 | 108.5° | 107.0° |
| C22 | C34 | H34 | 125.7° | 126.5° |
| C22 | N6 | C19 | 111.0° | 109.8° |
| C22 | N6 | H27 | 124.5° | 125.1° |
| C34 | C18 | C19 | 106.1° | 106.3° |
| C34 | C18 | C17 | 134.7° | 133.8° |
| C18 | C34 | H34 | 125.8° | 126.5° |
| N6 | C19 | C18 | 106.8° | 107.4° |
| N6 | C19 | C20 | 130.4° | 133.1° |
| C19 | N6 | H27 | 124.5° | 125.2° |
| C19 | C18 | C17 | 119.2° | 119.9° |
| C18 | C19 | C20 | 122.8° | 119.5° |
| C18 | C17 | C16 | 117.8° | 119.7° |
| C18 | C17 | H9 | 121.1° | 120.2° |
| C19 | C20 | C21 | 116.3° | 119.9° |
| C19 | C20 | H10 | 121.9° | 120.0° |
| C17 | C16 | C21 | 121.9° | 120.3° |
| C17 | C16 | F1 | 120.0° | 119.9° |
| C16 | C17 | H9 | 121.1° | 120.1° |
| C20 | C21 | C16 | 121.9° | 120.7° |
| C21 | C20 | H10 | 121.9° | 120.0° |
| C20 | C21 | H11 | 119.0° | 119.6° |
| C21 | C16 | F1 | 118.0° | 119.8° |
| C16 | C21 | H11 | 119.1° | 119.7° |
| H2 | C5 | H3 | 109.5° | 109.6° |
| H14 | C2 | H15 | 109.4° | 109.4° |
| H19 | N5 | H20 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C4 | C13 | C7 | 124.1° | 118.7° |
| O4 | C4 | C13 | H1 | 120.9° | 122.6° |
| O4 | C4 | C7 | H1 | 121.5° | 122.7° |
| O4 | C4 | C13 | C5 | 141.8° | 119.9° |
| O4 | C4 | C13 | O3 | 100.4° | 120.7° |
| O4 | C4 | C7 | O5 | 18.6° | 20.4° |
| O4 | C4 | C7 | C6 | 104.0° | 97.8° |
| O4 | C4 | C7 | H5 | 142.3° | 144.0° |
| O4 | C4 | C13 | H7 | 18.2° | 1.1° |
| C13 | C4 | C7 | H1 | 115.0° | 118.7° |
| C4 | C13 | C5 | O3 | 117.5° | 117.8° |
| C4 | C13 | C5 | H7 | 123.7° | 121.0° |
| C4 | C13 | O3 | H7 | 117.5° | 119.5° |
| C4 | C13 | C5 | O1 | 176.5° | 175.0° |
| C13 | C4 | C7 | O5 | 142.1° | 139.1° |
| C4 | C13 | O3 | C6 | 19.1° | 26.5° |
| C13 | C4 | C7 | C6 | 19.5° | 20.9° |
| C4 | C13 | C5 | H2 | 57.2° | 55.0° |
| C4 | C13 | C5 | H3 | 64.2° | 65.0° |
| C13 | C4 | C7 | H5 | 94.2° | 97.3° |
| C13 | C4 | O4 | H21 | 180.0° | 180.0° |
| C7 | C4 | C13 | C5 | 94.1° | 121.4° |
| C7 | C4 | C13 | O3 | 23.7° | 2.0° |
| C4 | C7 | O5 | C6 | 119.3° | 112.7° |
| C4 | C7 | O5 | H5 | 123.0° | 123.6° |
| C4 | C7 | C6 | O3 | 9.0° | 37.1° |
| C4 | C7 | C6 | H5 | 113.9° | 118.2° |
| C4 | C7 | C6 | N10 | 133.6° | 155.5° |
| C4 | C7 | C6 | H4 | 107.7° | 81.6° |
| C7 | C4 | C13 | H7 | 142.2° | 117.5° |
| C7 | C4 | O4 | H21 | 60.9° | 65.3° |
| C4 | C7 | O5 | H22 | 180.0° | 61.5° |
| C5 | C13 | O3 | H7 | 117.6° | 121.1° |
| C13 | C5 | O1 | H2 | 119.3° | 120.0° |
| C13 | C5 | O1 | H3 | 119.3° | 120.0° |
| C13 | C5 | O1 | P1 | 177.1° | 180.0° |
| C5 | C13 | O3 | C6 | 105.8° | 145.9° |
| C5 | C13 | C4 | H1 | 20.9° | 2.8° |
| C13 | C5 | H2 | H3 | 122.0° | 120.0° |
| O3 | C13 | C5 | O1 | 66.0° | 67.2° |
| C13 | O3 | C6 | C7 | 6.4° | 40.1° |
| C13 | O3 | C6 | N10 | 120.2° | 158.5° |
| O3 | C13 | C4 | H1 | 138.7° | 116.7° |
| O3 | C13 | C5 | H2 | 174.7° | 172.9° |
| O3 | C13 | C5 | H3 | 53.4° | 52.8° |
| C13 | O3 | C6 | H4 | 121.8° | 78.5° |
| C5 | O1 | P1 | O12 | 39.6° | 55.0° |
| C5 | O1 | P1 | O13 | 175.5° | 65.0° |
| C5 | O1 | P1 | O2 | 73.3° | 175.0° |
| O1 | C5 | H2 | H3 | 122.0° | 120.0° |
| O1 | C5 | C13 | H7 | 52.8° | 53.9° |
| O1 | P1 | O12 | O13 | 129.0° | 120.0° |
| O1 | P1 | O12 | O2 | 103.7° | 120.0° |
| O1 | P1 | O13 | O2 | 103.3° | 120.0° |
| O1 | P1 | O2 | P2 | 173.9° | 160.0° |
| P1 | O1 | C5 | H2 | 57.8° | 60.1° |
| P1 | O1 | C5 | H3 | 63.6° | 60.0° |
| O1 | P1 | O13 | H26 | 128.7° | 60.1° |
| O12 | P1 | O13 | O2 | 128.1° | 120.0° |
| O12 | P1 | O2 | P2 | 73.8° | 40.1° |
| O12 | P1 | O13 | H26 | 0.0° | 179.9° |
| O5 | C7 | C6 | O3 | 136.5° | 155.2° |
| O5 | C7 | C6 | H5 | 118.5° | 123.7° |
| O5 | C7 | C6 | N10 | 98.9° | 86.3° |
| O5 | C7 | C4 | H1 | 102.9° | 102.3° |
| O5 | C7 | C6 | H4 | 19.9° | 36.5° |
| O3 | C6 | C7 | N10 | 124.6° | 118.5° |
| O3 | C6 | C7 | H4 | 116.6° | 118.7° |
| O3 | C6 | N10 | H4 | 119.0° | 123.1° |
| O3 | C6 | N10 | C30 | 5.4° | 143.7° |
| O3 | C6 | N10 | C31 | 176.1° | 36.2° |
| O3 | C6 | C7 | H5 | 105.0° | 81.1° |
| C6 | O3 | C13 | H7 | 136.6° | 93.0° |
| C7 | C6 | N10 | H4 | 118.7° | 122.9° |
| C7 | C6 | N10 | C30 | 127.7° | 102.2° |
| C7 | C6 | N10 | C31 | 53.8° | 77.9° |
| C6 | C7 | C4 | H1 | 134.5° | 139.6° |
| C6 | C7 | O5 | H22 | 60.7° | 174.1° |
| O13 | P1 | O2 | P2 | 61.3° | 79.9° |
| P1 | O2 | P2 | O11 | 21.9° | 45.0° |
| P1 | O2 | P2 | O7 | 133.8° | 165.0° |
| P1 | O2 | P2 | O6 | 114.0° | 74.9° |
| O2 | P1 | O13 | H26 | 128.0° | 59.9° |
| C6 | N10 | C30 | C31 | 178.4° | 179.9° |
| C6 | N10 | C30 | C29 | 178.0° | 180.0° |
| C6 | N10 | C31 | C32 | 178.7° | 179.8° |
| N10 | C6 | C7 | H5 | 19.7° | 37.3° |
| C6 | N10 | C30 | H30 | 2.0° | 0.0° |
| C6 | N10 | C31 | H31 | 1.3° | 0.1° |
| O2 | P2 | O11 | O7 | 104.0° | 120.0° |
| O2 | P2 | O11 | O6 | 127.2° | 120.0° |
| O2 | P2 | O7 | O6 | 111.4° | 120.1° |
| O2 | P2 | O7 | C2 | 153.4° | 175.0° |
| O2 | P2 | O6 | H23 | 127.4° | 60.1° |
| N10 | C30 | C29 | H30 | 180.0° | 180.0° |
| C30 | N10 | C31 | C32 | 0.2° | 0.3° |
| N10 | C30 | C29 | C28 | 0.3° | 0.0° |
| C30 | N10 | C6 | H4 | 113.6° | 20.7° |
| N10 | C30 | C29 | H29 | 179.7° | 179.9° |
| C30 | N10 | C31 | H31 | 179.8° | 180.0° |
| C31 | N10 | C30 | C29 | 0.4° | 0.1° |
| N10 | C31 | C32 | H31 | 180.0° | 179.7° |
| N10 | C31 | C32 | C28 | 0.9° | 0.5° |
| C31 | N10 | C6 | H4 | 64.9° | 159.3° |
| C31 | N10 | C30 | H30 | 179.6° | 179.9° |
| N10 | C31 | C32 | H32 | 179.1° | 180.0° |
| C30 | C29 | C28 | H29 | 180.0° | 179.9° |
| C30 | C29 | C28 | C32 | 0.5° | 0.2° |
| C30 | C29 | C28 | C27 | 180.0° | 180.0° |
| C31 | C32 | C28 | C29 | 1.1° | 0.5° |
| C31 | C32 | C28 | H32 | 180.0° | 179.5° |
| C31 | C32 | C28 | C27 | 179.4° | 179.8° |
| O11 | P2 | O7 | O6 | 136.8° | 119.9° |
| O11 | P2 | O7 | C2 | 94.8° | 55.0° |
| O11 | P2 | O6 | H23 | 0.0° | 179.9° |
| P2 | O7 | C2 | C3 | 111.8° | 179.9° |
| P2 | O7 | C2 | H14 | 127.5° | 60.0° |
| P2 | O7 | C2 | H15 | 8.9° | 59.9° |
| O7 | P2 | O6 | H23 | 128.7° | 60.0° |
| O6 | P2 | O7 | C2 | 42.0° | 64.9° |
| O7 | C2 | C3 | C14 | 22.5° | 178.1° |
| O7 | C2 | C3 | H14 | 120.7° | 120.0° |
| O7 | C2 | C3 | H15 | 120.7° | 120.0° |
| O7 | C2 | C3 | O8 | 138.4° | 66.4° |
| O7 | C2 | H14 | H15 | 117.9° | 120.0° |
| O7 | C2 | C3 | H16 | 101.8° | 55.8° |
| C29 | C28 | C32 | C27 | 179.5° | 179.8° |
| C29 | C28 | C27 | C33 | 4.4° | 180.0° |
| C29 | C28 | C27 | N9 | 174.7° | 0.1° |
| C28 | C29 | C30 | H30 | 179.7° | 180.0° |
| C29 | C28 | C32 | H32 | 179.0° | 180.0° |
| C32 | C28 | C27 | C33 | 176.1° | 0.3° |
| C32 | C28 | C27 | N9 | 4.8° | 179.8° |
| C32 | C28 | C29 | H29 | 179.5° | 179.9° |
| C28 | C32 | C31 | H31 | 179.1° | 179.8° |
| C28 | C27 | C33 | N9 | 179.2° | 179.9° |
| C28 | C27 | C33 | N8 | 179.1° | 180.0° |
| C28 | C27 | N9 | C26 | 179.9° | 180.0° |
| C27 | C28 | C29 | H29 | 0.0° | 0.1° |
| C27 | C28 | C32 | H32 | 0.5° | 0.3° |
| C28 | C27 | C33 | H33 | 0.9° | 0.1° |
| O10 | C14 | C1 | C3 | 122.9° | 118.7° |
| O10 | C14 | C1 | H18 | 120.5° | 122.5° |
| O10 | C14 | C3 | H18 | 122.5° | 122.7° |
| O10 | C14 | C3 | C2 | 148.2° | 98.5° |
| O10 | C14 | C1 | O9 | 25.1° | 0.0° |
| O10 | C14 | C1 | C15 | 94.0° | 118.7° |
| O10 | C14 | C3 | O8 | 92.7° | 142.6° |
| O10 | C14 | C1 | H13 | 150.9° | 122.7° |
| O10 | C14 | C3 | H16 | 24.0° | 23.7° |
| C1 | C14 | C3 | H18 | 116.8° | 118.7° |
| C1 | C14 | C3 | C2 | 91.1° | 142.8° |
| C14 | C1 | O9 | C15 | 113.3° | 114.7° |
| C14 | C1 | O9 | H13 | 125.1° | 122.7° |
| C14 | C1 | C15 | H13 | 115.0° | 118.7° |
| C1 | C14 | C3 | O8 | 28.0° | 24.0° |
| C14 | C1 | C15 | O8 | 19.9° | 24.0° |
| C14 | C1 | C15 | N3 | 145.8° | 142.8° |
| C14 | C1 | C15 | H8 | 96.2° | 94.9° |
| C1 | C14 | C3 | H16 | 144.8° | 94.9° |
| C14 | C1 | O9 | H24 | 180.0° | 65.4° |
| C1 | C14 | O10 | H25 | 180.0° | 61.4° |
| C14 | C3 | C2 | O8 | 115.9° | 115.4° |
| C14 | C3 | C2 | H16 | 124.3° | 122.4° |
| C3 | C14 | C1 | O9 | 148.0° | 118.7° |
| C3 | C14 | C1 | C15 | 28.9° | 0.0° |
| C14 | C3 | O8 | H16 | 115.7° | 119.0° |
| C14 | C3 | O8 | C15 | 15.6° | 40.5° |
| C3 | C14 | C1 | H13 | 86.2° | 118.6° |
| C14 | C3 | C2 | H14 | 143.2° | 58.1° |
| C14 | C3 | C2 | H15 | 98.2° | 61.9° |
| C3 | C14 | O10 | H25 | 61.3° | 176.1° |
| C2 | C3 | O8 | H16 | 118.7° | 122.2° |
| C2 | C3 | O8 | C15 | 110.1° | 159.4° |
| C3 | C2 | H14 | H15 | 117.9° | 120.0° |
| C2 | C3 | C14 | H18 | 25.7° | 24.2° |
| O9 | C1 | C15 | H13 | 122.4° | 122.6° |
| O9 | C1 | C15 | O8 | 142.4° | 142.8° |
| O9 | C1 | C15 | N3 | 91.7° | 98.4° |
| O9 | C1 | C15 | H8 | 26.3° | 23.9° |
| O9 | C1 | C14 | H18 | 95.3° | 122.5° |
| C1 | C15 | O8 | C3 | 2.8° | 40.5° |
| C1 | C15 | N3 | C8 | 51.6° | 91.7° |
| C1 | C15 | O8 | N3 | 128.2° | 118.8° |
| C1 | C15 | O8 | H8 | 115.1° | 118.9° |
| C1 | C15 | N3 | H8 | 117.9° | 122.4° |
| C1 | C15 | N3 | C10 | 123.2° | 88.2° |
| C15 | C1 | C14 | H18 | 145.5° | 118.8° |
| C15 | C1 | O9 | H24 | 66.6° | 180.0° |
| C3 | O8 | C15 | N3 | 131.0° | 159.3° |
| C3 | O8 | C15 | H8 | 112.3° | 78.4° |
| O8 | C3 | C2 | H14 | 100.9° | 173.5° |
| O8 | C3 | C2 | H15 | 17.7° | 53.6° |
| O8 | C3 | C14 | H18 | 144.8° | 94.7° |
| C27 | C33 | N8 | H33 | 180.0° | 179.9° |
| C33 | C27 | N9 | C26 | 0.9° | 0.1° |
| C27 | C33 | N8 | C26 | 1.7° | 0.0° |
| C27 | C33 | N8 | C25 | 178.9° | 180.0° |
| N9 | C27 | C33 | N8 | 1.7° | 0.1° |
| C27 | N9 | C26 | N8 | 0.3° | 0.1° |
| C27 | N9 | C26 | C24 | 178.4° | 180.0° |
| N9 | C27 | C33 | H33 | 178.3° | 180.0° |
| N3 | C8 | N1 | H6 | 180.0° | 180.0° |
| C8 | N3 | C15 | O8 | 72.9° | 23.6° |
| C8 | N3 | C15 | C10 | 174.8° | 179.9° |
| N3 | C8 | N1 | C9 | 0.0° | 0.0° |
| C8 | N3 | C10 | C9 | 1.4° | 0.0° |
| C8 | N3 | C10 | N4 | 179.0° | 180.0° |
| C8 | N3 | C15 | H8 | 169.6° | 145.9° |
| N1 | C8 | N3 | C15 | 176.5° | 179.9° |
| N1 | C8 | N3 | C10 | 0.9° | 0.0° |
| C8 | N1 | C9 | C10 | 1.0° | 0.0° |
| C8 | N1 | C9 | C12 | 179.0° | 180.0° |
| C33 | N8 | C26 | N9 | 1.3° | 0.0° |
| C33 | N8 | C26 | C25 | 179.5° | 180.0° |
| C33 | N8 | C26 | C24 | 177.6° | 180.0° |
| C33 | N8 | C25 | C23 | 179.4° | 179.7° |
| C33 | N8 | C25 | H28 | 0.6° | 0.2° |
| O8 | C15 | N3 | H8 | 117.5° | 122.3° |
| O8 | C15 | N3 | C10 | 112.3° | 156.5° |
| O8 | C15 | C1 | H13 | 95.2° | 94.7° |
| C15 | O8 | C3 | H16 | 131.2° | 78.5° |
| C15 | N3 | C10 | C9 | 177.2° | 180.0° |
| C15 | N3 | C10 | N4 | 3.2° | 0.1° |
| C15 | N3 | C8 | H6 | 3.5° | 0.0° |
| N3 | C15 | C1 | H13 | 30.7° | 24.1° |
| N9 | C26 | N8 | C24 | 178.9° | 180.0° |
| N9 | C26 | N8 | C25 | 179.2° | 179.9° |
| N9 | C26 | C24 | N7 | 178.4° | 180.0° |
| N9 | C26 | C24 | H12 | 1.5° | 0.4° |
| N3 | C10 | C9 | N1 | 1.5° | 0.0° |
| N3 | C10 | C9 | N4 | 179.6° | 180.0° |
| N3 | C10 | C9 | C12 | 178.4° | 180.0° |
| N3 | C10 | N4 | C11 | 177.8° | 179.9° |
| C10 | N3 | C8 | H6 | 179.1° | 180.0° |
| C10 | N3 | C15 | H8 | 5.2° | 34.2° |
| N1 | C9 | C10 | C12 | 180.0° | 180.0° |
| N1 | C9 | C10 | N4 | 178.9° | 180.0° |
| N1 | C9 | C12 | N5 | 1.2° | 0.0° |
| N1 | C9 | C12 | N2 | 179.6° | 180.0° |
| C9 | N1 | C8 | H6 | 180.0° | 180.0° |
| C26 | N8 | C25 | C23 | 0.1° | 0.2° |
| N8 | C26 | C24 | N7 | 2.9° | 0.1° |
| N8 | C26 | C24 | H12 | 177.1° | 179.7° |
| C26 | N8 | C25 | H28 | 179.9° | 179.8° |
| C26 | N8 | C33 | H33 | 178.3° | 180.0° |
| C24 | C26 | N8 | C25 | 1.9° | 0.0° |
| C26 | C24 | N7 | H12 | 180.0° | 179.6° |
| C26 | C24 | N7 | C23 | 1.8° | 0.4° |
| N8 | C25 | C23 | H28 | 180.0° | 179.5° |
| N8 | C25 | C23 | N7 | 1.2° | 0.5° |
| N8 | C25 | C23 | C22 | 177.4° | 180.0° |
| C25 | N8 | C33 | H33 | 1.1° | 0.1° |
| C9 | C10 | N4 | C11 | 1.7° | 0.0° |
| C10 | C9 | C12 | N5 | 178.7° | 180.0° |
| C10 | C9 | C12 | N2 | 0.5° | 0.0° |
| N4 | C10 | C9 | C12 | 1.2° | 0.0° |
| C10 | N4 | C11 | N2 | 1.8° | 0.1° |
| C10 | N4 | C11 | H17 | 178.2° | 179.9° |
| C9 | C12 | N5 | N2 | 179.3° | 180.0° |
| C9 | C12 | N2 | C11 | 0.5° | 0.0° |
| C9 | C12 | N5 | H19 | 179.3° | 0.0° |
| C9 | C12 | N5 | H20 | 59.3° | 180.0° |
| C25 | C23 | N7 | C24 | 0.3° | 0.6° |
| C25 | C23 | N7 | C22 | 178.8° | 179.4° |
| C25 | C23 | C22 | C34 | 42.3° | 179.4° |
| C25 | C23 | C22 | N6 | 136.3° | 0.5° |
| C24 | N7 | C23 | C22 | 178.5° | 179.9° |
| N4 | C11 | N2 | C12 | 1.3° | 0.1° |
| N4 | C11 | N2 | H17 | 180.0° | 180.0° |
| N5 | C12 | N2 | C11 | 178.8° | 180.0° |
| C12 | N5 | H19 | H20 | 120.0° | 180.0° |
| C12 | N2 | C11 | H17 | 178.7° | 179.9° |
| N2 | C12 | N5 | H19 | 0.0° | 179.9° |
| N2 | C12 | N5 | H20 | 120.0° | 0.1° |
| N7 | C23 | C22 | C34 | 138.9° | 0.0° |
| N7 | C23 | C22 | N6 | 42.4° | 179.9° |
| C23 | N7 | C24 | H12 | 178.2° | 180.0° |
| N7 | C23 | C25 | H28 | 178.8° | 179.9° |
| C23 | C22 | C34 | N6 | 178.8° | 179.9° |
| C23 | C22 | C34 | C18 | 178.7° | 179.9° |
| C23 | C22 | N6 | C19 | 176.8° | 180.0° |
| C23 | C22 | N6 | H27 | 3.2° | 0.1° |
| C22 | C23 | C25 | H28 | 2.6° | 0.5° |
| C23 | C22 | C34 | H34 | 1.3° | 0.0° |
| C22 | C34 | C18 | H34 | 180.0° | 179.9° |
| C34 | C22 | N6 | C19 | 2.1° | 0.0° |
| C22 | C34 | C18 | C19 | 1.8° | 0.0° |
| C22 | C34 | C18 | C17 | 179.0° | 180.0° |
| C34 | C22 | N6 | H27 | 177.9° | 179.9° |
| N6 | C22 | C34 | C18 | 0.1° | 0.0° |
| C22 | N6 | C19 | H27 | 180.0° | 179.9° |
| C22 | N6 | C19 | C18 | 3.2° | 0.0° |
| C22 | N6 | C19 | C20 | 175.3° | 180.0° |
| N6 | C22 | C34 | H34 | 179.9° | 179.9° |
| C34 | C18 | C19 | N6 | 3.0° | 0.0° |
| C34 | C18 | C19 | C17 | 177.8° | 180.0° |
| C34 | C18 | C19 | C20 | 175.7° | 180.0° |
| C34 | C18 | C17 | C16 | 172.5° | 180.0° |
| C34 | C18 | C17 | H9 | 7.5° | 0.3° |
| N6 | C19 | C18 | C20 | 178.7° | 180.0° |
| N6 | C19 | C18 | C17 | 179.3° | 180.0° |
| N6 | C19 | C20 | C21 | 177.4° | 179.7° |
| N6 | C19 | C20 | H10 | 2.6° | 0.2° |
| C19 | C18 | C17 | C16 | 4.5° | 0.0° |
| C18 | C19 | C20 | C21 | 0.9° | 0.3° |
| C19 | C18 | C17 | H9 | 175.5° | 179.7° |
| C18 | C19 | C20 | H10 | 179.1° | 179.7° |
| C18 | C19 | N6 | H27 | 176.8° | 179.9° |
| C19 | C18 | C34 | H34 | 178.2° | 180.0° |
| C17 | C18 | C19 | C20 | 2.1° | 0.0° |
| C18 | C17 | C16 | H9 | 180.0° | 179.7° |
| C18 | C17 | C16 | C21 | 4.1° | 0.2° |
| C18 | C17 | C16 | F1 | 172.1° | 179.7° |
| C17 | C18 | C34 | H34 | 1.0° | 0.1° |
| C19 | C20 | C21 | H10 | 180.0° | 179.4° |
| C19 | C20 | C21 | C16 | 1.5° | 0.5° |
| C19 | C20 | C21 | H11 | 178.5° | 179.5° |
| C20 | C19 | N6 | H27 | 4.7° | 0.1° |
| C17 | C16 | C21 | C20 | 1.1° | 0.5° |
| C17 | C16 | C21 | F1 | 176.3° | 180.0° |
| C17 | C16 | C21 | H11 | 178.9° | 179.5° |
| C20 | C21 | C16 | H11 | 180.0° | 180.0° |
| C20 | C21 | C16 | F1 | 175.2° | 179.4° |
| C21 | C16 | C17 | H9 | 175.9° | 180.0° |
| C16 | C21 | C20 | H10 | 178.6° | 180.0° |
| F1 | C16 | C17 | H9 | 7.9° | 0.0° |
| F1 | C16 | C21 | H11 | 4.8° | 0.5° |
| H1 | C4 | C7 | H5 | 20.7° | 21.3° |
| H1 | C4 | C13 | H7 | 102.8° | 123.8° |
| H1 | C4 | O4 | H21 | 59.8° | 57.4° |
| H2 | C5 | C13 | H7 | 66.5° | 66.0° |
| H3 | C5 | C13 | H7 | 172.1° | 173.9° |
| H4 | C6 | C7 | H5 | 138.4° | 160.2° |
| H5 | C7 | O5 | H22 | 57.0° | 62.2° |
| H8 | C15 | C1 | H13 | 148.7° | 146.4° |
| H10 | C20 | C21 | H11 | 1.4° | 0.0° |
| H13 | C1 | C14 | H18 | 30.5° | 0.2° |
| H13 | C1 | O9 | H24 | 55.0° | 57.4° |
| H14 | C2 | C3 | H16 | 18.9° | 64.3° |
| H15 | C2 | C3 | H16 | 137.5° | 175.8° |
| H16 | C3 | C14 | H18 | 98.5° | 146.4° |
| H18 | C14 | O10 | H25 | 60.4° | 61.1° |
| H29 | C29 | C30 | H30 | 0.3° | 0.1° |
| H31 | C31 | C32 | H32 | 0.9° | 0.3° |
