EAD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P1 | O1 | doub | 1.48Å | 1.51Å | |
| P1 | O2 | sing | 1.61Å | 1.48Å | |
| P1 | O3 | sing | 1.61Å | 1.65Å | |
| P1 | O7 | sing | 1.61Å | 1.58Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| O3 | C1 | sing | 1.43Å | 1.48Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12A | sing | 1.09Å | 1.10Å | |
| C2 | O4 | sing | 1.44Å | 1.49Å | |
| C2 | C3 | sing | 1.54Å | 1.51Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O4 | C5 | sing | 1.44Å | 1.38Å | |
| C3 | O5 | sing | 1.43Å | 1.41Å | |
| C3 | C4 | sing | 1.55Å | 1.47Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C4 | O6 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.55Å | 1.54Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C5 | N1 | sing | 1.46Å | 1.56Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| N1 | C6 | sing | 1.36Å | 1.35Å | Aromatic |
| N1 | C10 | sing | 1.37Å | 1.38Å | Aromatic |
| C6 | N2 | doub | 1.30Å | 1.33Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| N2 | C7 | sing | 1.35Å | 1.28Å | Aromatic |
| C7 | C8 | sing | 1.41Å | 1.46Å | Aromatic |
| C7 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C8 | N3 | sing | 1.38Å | 1.17Å | |
| C8 | N4 | doub | 1.33Å | 1.38Å | Aromatic |
| N3 | HN31 | sing | 0.97Å | 1.00Å | |
| N3 | HN32 | sing | 0.97Å | 1.00Å | |
| N4 | C9 | sing | 1.32Å | 1.38Å | Aromatic |
| C9 | N5 | doub | 1.32Å | 1.37Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| N5 | C10 | sing | 1.33Å | 1.49Å | Aromatic |
| O7 | P2 | sing | 1.61Å | 1.59Å | |
| P2 | O8 | doub | 1.48Å | 1.50Å | |
| P2 | O9 | sing | 1.61Å | 1.50Å | |
| P2 | O10 | sing | 1.61Å | 1.60Å | |
| O9 | HO9 | sing | 0.97Å | 0.95Å | |
| O10 | C11 | sing | 1.43Å | 1.42Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C12 | O11 | sing | 1.44Å | 1.46Å | |
| C12 | C13 | sing | 1.54Å | 1.57Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| O11 | C15 | sing | 1.44Å | 1.43Å | |
| C13 | O12 | sing | 1.43Å | 1.42Å | |
| C13 | C14 | sing | 1.55Å | 1.50Å | |
| C13 | H1 | sing | 1.09Å | 1.10Å | |
| O12 | H7 | sing | 0.97Å | 0.95Å | |
| C14 | O13 | sing | 1.43Å | 1.43Å | |
| C14 | C15 | sing | 1.55Å | 1.51Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| O13 | H13 | sing | 0.97Å | 0.95Å | |
| C15 | N6 | sing | 1.47Å | 1.49Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| N6 | C16 | sing | 1.37Å | 1.45Å | |
| N6 | C21 | sing | 1.39Å | 1.41Å | |
| C16 | C17 | doub | 1.35Å | 1.44Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | C18 | sing | 1.41Å | 1.56Å | |
| C17 | C19 | sing | 1.50Å | 1.49Å | |
| C18 | O14 | doub | 1.22Å | 1.24Å | |
| C18 | N7 | sing | 1.35Å | 1.34Å | |
| N7 | HN71 | sing | 0.97Å | 1.00Å | |
| N7 | HN72 | sing | 0.97Å | 1.00Å | |
| C19 | C20 | sing | 1.50Å | 1.46Å | |
| C19 | C22 | sing | 1.51Å | 1.62Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | C21 | doub | 1.32Å | 1.40Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | O15 | doub | 1.21Å | 1.28Å | |
| C22 | C25 | sing | 1.47Å | 1.56Å | |
| N8 | C23 | sing | 1.32Å | 1.38Å | Aromatic |
| N8 | C27 | doub | 1.32Å | 1.37Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | C25 | sing | 1.40Å | 1.44Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | C26 | doub | 1.40Å | 1.46Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.43Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | C28 | sing | 1.51Å | 1.53Å | |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | P1 | O2 | 117.9° | 109.5° |
| O1 | P1 | O3 | 114.9° | 109.5° |
| O1 | P1 | O7 | 102.0° | 109.5° |
| O2 | P1 | O3 | 102.8° | 109.4° |
| O2 | P1 | O7 | 105.7° | 109.5° |
| P1 | O2 | HO2 | 109.5° | 114.0° |
| O3 | P1 | O7 | 113.5° | 109.5° |
| P1 | O3 | C1 | 130.6° | 123.0° |
| P1 | O7 | P2 | 135.0° | 134.0° |
| O3 | C1 | C2 | 122.8° | 109.5° |
| O3 | C1 | H11 | 102.1° | 109.4° |
| O3 | C1 | H12A | 105.3° | 109.4° |
| C2 | C1 | H11 | 102.1° | 109.5° |
| C2 | C1 | H12A | 105.3° | 109.5° |
| C1 | C2 | O4 | 114.0° | 109.9° |
| C1 | C2 | C3 | 114.1° | 109.9° |
| C1 | C2 | H2 | 100.6° | 109.9° |
| H11 | C1 | H12A | 120.6° | 109.5° |
| O4 | C2 | C3 | 100.4° | 107.3° |
| O4 | C2 | H2 | 114.2° | 109.8° |
| C2 | O4 | C5 | 93.2° | 107.0° |
| C3 | C2 | H2 | 114.2° | 110.0° |
| C2 | C3 | O5 | 108.4° | 110.5° |
| C2 | C3 | C4 | 103.9° | 104.2° |
| C2 | C3 | H3 | 114.8° | 110.4° |
| O4 | C5 | C4 | 101.6° | 103.5° |
| O4 | C5 | N1 | 127.2° | 110.6° |
| O4 | C5 | H5 | 101.2° | 110.6° |
| O5 | C3 | C4 | 112.8° | 110.5° |
| O5 | C3 | H3 | 106.3° | 110.5° |
| C3 | O5 | HO5 | 109.5° | 114.0° |
| C4 | C3 | H3 | 110.7° | 110.6° |
| C3 | C4 | O6 | 117.5° | 110.9° |
| C3 | C4 | C5 | 99.1° | 102.1° |
| C3 | C4 | H4 | 115.3° | 110.9° |
| O6 | C4 | C5 | 119.1° | 110.9° |
| O6 | C4 | H4 | 93.3° | 110.8° |
| C4 | O6 | HO6 | 109.5° | 114.0° |
| C5 | C4 | H4 | 113.6° | 110.9° |
| C4 | C5 | N1 | 101.1° | 110.6° |
| C4 | C5 | H5 | 127.2° | 110.6° |
| N1 | C5 | H5 | 101.7° | 110.6° |
| C5 | N1 | C6 | 137.8° | 126.3° |
| C5 | N1 | C10 | 110.7° | 126.3° |
| C6 | N1 | C10 | 102.4° | 107.4° |
| N1 | C6 | N2 | 115.4° | 110.0° |
| N1 | C6 | H6 | 122.3° | 125.0° |
| N1 | C10 | C7 | 105.9° | 106.0° |
| N1 | C10 | N5 | 136.6° | 134.9° |
| N2 | C6 | H6 | 122.3° | 125.0° |
| C6 | N2 | C7 | 103.9° | 109.4° |
| N2 | C7 | C8 | 127.5° | 134.7° |
| N2 | C7 | C10 | 112.3° | 107.1° |
| C8 | C7 | C10 | 120.2° | 118.2° |
| C7 | C8 | N3 | 116.7° | 120.7° |
| C7 | C8 | N4 | 118.8° | 118.5° |
| C7 | C10 | N5 | 117.4° | 119.1° |
| N3 | C8 | N4 | 124.4° | 120.8° |
| C8 | N3 | HN31 | 125.9° | 120.0° |
| C8 | N3 | HN32 | 108.2° | 120.0° |
| C8 | N4 | C9 | 122.5° | 121.2° |
| HN31 | N3 | HN32 | 125.9° | 120.0° |
| N4 | C9 | N5 | 120.7° | 122.4° |
| N4 | C9 | H9 | 119.7° | 118.8° |
| N5 | C9 | H9 | 119.6° | 118.8° |
| C9 | N5 | C10 | 120.3° | 120.6° |
| O7 | P2 | O8 | 111.5° | 109.5° |
| O7 | P2 | O9 | 100.7° | 109.5° |
| O7 | P2 | O10 | 103.2° | 109.5° |
| O8 | P2 | O9 | 119.3° | 109.5° |
| O8 | P2 | O10 | 110.3° | 109.5° |
| O9 | P2 | O10 | 110.3° | 109.5° |
| P2 | O9 | HO9 | 109.5° | 114.0° |
| P2 | O10 | C11 | 123.5° | 123.0° |
| O10 | C11 | C12 | 112.0° | 109.5° |
| O10 | C11 | H111 | 108.1° | 109.5° |
| O10 | C11 | H112 | 108.6° | 109.5° |
| C12 | C11 | H111 | 108.0° | 109.4° |
| C12 | C11 | H112 | 108.6° | 109.4° |
| C11 | C12 | O11 | 106.7° | 109.9° |
| C11 | C12 | C13 | 118.7° | 109.9° |
| C11 | C12 | H12 | 104.0° | 109.9° |
| H111 | C11 | H112 | 111.5° | 109.5° |
| O11 | C12 | C13 | 105.5° | 107.3° |
| O11 | C12 | H12 | 117.5° | 109.9° |
| C12 | O11 | C15 | 107.5° | 107.0° |
| C13 | C12 | H12 | 105.1° | 110.0° |
| C12 | C13 | O12 | 116.8° | 110.5° |
| C12 | C13 | C14 | 101.3° | 104.2° |
| C12 | C13 | H1 | 112.2° | 110.5° |
| O11 | C15 | C14 | 105.4° | 103.5° |
| O11 | C15 | N6 | 113.1° | 110.6° |
| O11 | C15 | H15 | 110.5° | 110.6° |
| O12 | C13 | C14 | 114.4° | 110.5° |
| O12 | C13 | H1 | 98.3° | 110.5° |
| C13 | O12 | H7 | 109.5° | 113.9° |
| C14 | C13 | H1 | 114.6° | 110.6° |
| C13 | C14 | O13 | 124.3° | 110.9° |
| C13 | C14 | C15 | 100.4° | 102.1° |
| C13 | C14 | H14 | 107.9° | 111.0° |
| O13 | C14 | C15 | 114.1° | 110.9° |
| O13 | C14 | H14 | 91.9° | 110.8° |
| C14 | O13 | H13 | 109.5° | 114.0° |
| C15 | C14 | H14 | 119.6° | 110.9° |
| C14 | C15 | N6 | 111.3° | 110.6° |
| C14 | C15 | H15 | 112.3° | 110.6° |
| N6 | C15 | H15 | 104.4° | 110.7° |
| C15 | N6 | C16 | 125.6° | 119.9° |
| C15 | N6 | C21 | 113.0° | 120.0° |
| C16 | N6 | C21 | 121.4° | 120.1° |
| N6 | C16 | C17 | 120.0° | 120.4° |
| N6 | C16 | H16 | 120.0° | 119.8° |
| N6 | C21 | C20 | 119.5° | 120.9° |
| N6 | C21 | H21 | 120.2° | 119.5° |
| C17 | C16 | H16 | 120.0° | 119.8° |
| C16 | C17 | C18 | 121.1° | 119.3° |
| C16 | C17 | C19 | 118.5° | 121.3° |
| C18 | C17 | C19 | 120.4° | 119.3° |
| C17 | C18 | O14 | 121.5° | 120.0° |
| C17 | C18 | N7 | 115.5° | 120.0° |
| C17 | C19 | C20 | 117.8° | 110.9° |
| C17 | C19 | C22 | 110.3° | 109.2° |
| C17 | C19 | H19 | 100.6° | 109.2° |
| O14 | C18 | N7 | 123.0° | 120.0° |
| C18 | N7 | HN71 | 125.4° | 120.0° |
| C18 | N7 | HN72 | 109.2° | 119.9° |
| HN71 | N7 | HN72 | 125.4° | 120.0° |
| C20 | C19 | C22 | 99.9° | 109.2° |
| C20 | C19 | H19 | 110.9° | 109.2° |
| C19 | C20 | C21 | 122.7° | 121.8° |
| C19 | C20 | H20 | 118.6° | 119.1° |
| C22 | C19 | H19 | 118.3° | 109.1° |
| C19 | C22 | O15 | 117.8° | 119.9° |
| C19 | C22 | C25 | 126.2° | 120.0° |
| C21 | C20 | H20 | 118.6° | 119.1° |
| C20 | C21 | H21 | 120.3° | 119.6° |
| O15 | C22 | C25 | 115.9° | 120.0° |
| C22 | C25 | C24 | 122.1° | 120.9° |
| C22 | C25 | C26 | 118.4° | 121.0° |
| C23 | N8 | C27 | 124.2° | 122.1° |
| N8 | C23 | C24 | 119.4° | 120.9° |
| N8 | C23 | H23 | 120.3° | 119.5° |
| N8 | C27 | C26 | 119.1° | 120.9° |
| N8 | C27 | C28 | 116.6° | 119.5° |
| C24 | C23 | H23 | 120.3° | 119.6° |
| C23 | C24 | C25 | 119.6° | 119.0° |
| C23 | C24 | H24 | 120.2° | 120.5° |
| C25 | C24 | H24 | 120.2° | 120.5° |
| C24 | C25 | C26 | 119.5° | 118.1° |
| C25 | C26 | C27 | 118.2° | 119.0° |
| C25 | C26 | H26 | 120.9° | 120.5° |
| C27 | C26 | H26 | 120.9° | 120.5° |
| C26 | C27 | C28 | 124.3° | 119.5° |
| C27 | C28 | C29 | 114.3° | 109.4° |
| C27 | C28 | H281 | 106.8° | 109.5° |
| C27 | C28 | H282 | 107.9° | 109.5° |
| C29 | C28 | H281 | 106.8° | 109.5° |
| C29 | C28 | H282 | 107.9° | 109.5° |
| C28 | C29 | H291 | 109.5° | 109.5° |
| C28 | C29 | H292 | 109.5° | 109.5° |
| C28 | C29 | H293 | 109.5° | 109.4° |
| H281 | C28 | H282 | 113.3° | 109.5° |
| H291 | C29 | H292 | 109.4° | 109.6° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | P1 | O2 | O3 | 127.5° | 120.0° |
| O1 | P1 | O2 | O7 | 113.2° | 120.0° |
| O1 | P1 | O3 | O7 | 117.0° | 120.0° |
| O1 | P1 | O2 | HO2 | 62.4° | 179.9° |
| O1 | P1 | O3 | C1 | 51.4° | 55.0° |
| O1 | P1 | O7 | P2 | 161.0° | 40.0° |
| O2 | P1 | O3 | O7 | 113.7° | 120.0° |
| O2 | P1 | O3 | C1 | 179.3° | 65.0° |
| O2 | P1 | O7 | P2 | 75.1° | 80.0° |
| O3 | P1 | O2 | HO2 | 170.1° | 60.1° |
| P1 | O3 | C1 | C2 | 109.4° | 180.0° |
| P1 | O3 | C1 | H11 | 3.8° | 60.0° |
| P1 | O3 | C1 | H12A | 130.5° | 60.0° |
| O3 | P1 | O7 | P2 | 36.8° | 160.0° |
| O7 | P1 | O2 | HO2 | 50.8° | 59.9° |
| O7 | P1 | O3 | C1 | 65.6° | 175.0° |
| P1 | O7 | P2 | O8 | 156.6° | 45.0° |
| P1 | O7 | P2 | O9 | 29.0° | 75.0° |
| P1 | O7 | P2 | O10 | 85.0° | 165.0° |
| O3 | C1 | C2 | H11 | 113.2° | 119.9° |
| O3 | C1 | C2 | H12A | 120.0° | 120.0° |
| O3 | C1 | H11 | H12A | 116.1° | 120.0° |
| O3 | C1 | C2 | O4 | 116.0° | 66.5° |
| O3 | C1 | C2 | C3 | 1.4° | 175.7° |
| O3 | C1 | C2 | H2 | 121.3° | 54.5° |
| C2 | C1 | H11 | H12A | 116.1° | 120.1° |
| C1 | C2 | O4 | C3 | 122.4° | 119.4° |
| C1 | C2 | O4 | H2 | 115.0° | 121.1° |
| C1 | C2 | C3 | H2 | 115.0° | 121.1° |
| C1 | C2 | O4 | C5 | 179.6° | 145.9° |
| C1 | C2 | C3 | O5 | 86.8° | 119.8° |
| C1 | C2 | C3 | C4 | 153.0° | 121.4° |
| C1 | C2 | C3 | H3 | 31.9° | 2.7° |
| H11 | C1 | C2 | O4 | 2.8° | 53.5° |
| H11 | C1 | C2 | C3 | 111.8° | 64.3° |
| H11 | C1 | C2 | H2 | 125.5° | 174.5° |
| H12A | C1 | C2 | O4 | 124.0° | 173.6° |
| H12A | C1 | C2 | C3 | 121.4° | 55.7° |
| H12A | C1 | C2 | H2 | 1.3° | 65.4° |
| O4 | C2 | C3 | H2 | 122.7° | 119.4° |
| O4 | C2 | C3 | O5 | 150.8° | 120.7° |
| O4 | C2 | C3 | C4 | 30.6° | 2.0° |
| O4 | C2 | C3 | H3 | 90.4° | 116.8° |
| C2 | O4 | C5 | C4 | 62.0° | 40.1° |
| C2 | O4 | C5 | N1 | 175.8° | 158.6° |
| C2 | O4 | C5 | H5 | 70.1° | 78.5° |
| C3 | C2 | O4 | C5 | 57.1° | 26.5° |
| C2 | C3 | O5 | C4 | 114.5° | 114.8° |
| C2 | C3 | O5 | H3 | 124.0° | 122.5° |
| C2 | C3 | C4 | H3 | 123.8° | 118.7° |
| C2 | C3 | O5 | HO5 | 141.6° | 180.0° |
| C2 | C3 | C4 | O6 | 135.2° | 139.1° |
| C2 | C3 | C4 | C5 | 5.5° | 20.9° |
| C2 | C3 | C4 | H4 | 116.2° | 97.3° |
| H2 | C2 | O4 | C5 | 65.5° | 93.0° |
| H2 | C2 | C3 | O5 | 28.1° | 1.3° |
| H2 | C2 | C3 | C4 | 92.0° | 117.4° |
| H2 | C2 | C3 | H3 | 146.9° | 123.8° |
| O4 | C5 | C4 | C3 | 43.7° | 37.0° |
| O4 | C5 | C4 | O6 | 172.3° | 155.2° |
| O4 | C5 | C4 | N1 | 132.0° | 118.5° |
| O4 | C5 | C4 | H5 | 113.9° | 118.5° |
| O4 | C5 | C4 | H4 | 79.2° | 81.2° |
| O4 | C5 | N1 | H5 | 113.9° | 123.0° |
| O4 | C5 | N1 | C6 | 1.2° | 23.6° |
| O4 | C5 | N1 | C10 | 138.0° | 156.8° |
| O5 | C3 | C4 | H3 | 119.0° | 122.6° |
| O5 | C3 | C4 | O6 | 18.0° | 20.4° |
| O5 | C3 | C4 | C5 | 111.7° | 97.8° |
| O5 | C3 | C4 | H4 | 126.6° | 144.0° |
| C4 | C3 | O5 | HO5 | 103.9° | 65.2° |
| C3 | C4 | O6 | C5 | 119.6° | 112.7° |
| C3 | C4 | O6 | H4 | 120.9° | 123.7° |
| C3 | C4 | C5 | H4 | 122.9° | 118.2° |
| C3 | C4 | O6 | HO6 | 74.6° | 61.5° |
| C3 | C4 | C5 | N1 | 175.7° | 155.5° |
| C3 | C4 | C5 | H5 | 70.2° | 81.5° |
| H3 | C3 | O5 | HO5 | 17.6° | 57.5° |
| H3 | C3 | C4 | O6 | 101.0° | 102.2° |
| H3 | C3 | C4 | C5 | 129.3° | 139.6° |
| H3 | C3 | C4 | H4 | 7.6° | 21.4° |
| O6 | C4 | C5 | H4 | 108.4° | 123.6° |
| O6 | C4 | C5 | N1 | 55.7° | 86.3° |
| O6 | C4 | C5 | H5 | 58.5° | 36.7° |
| C5 | C4 | O6 | HO6 | 165.7° | 174.2° |
| C4 | C5 | N1 | H5 | 132.1° | 123.0° |
| C4 | C5 | N1 | C6 | 112.8° | 90.5° |
| C4 | C5 | N1 | C10 | 108.0° | 89.2° |
| H4 | C4 | O6 | HO6 | 46.3° | 62.2° |
| H4 | C4 | C5 | N1 | 52.8° | 37.3° |
| H4 | C4 | C5 | H5 | 166.9° | 160.3° |
| C5 | N1 | C6 | C10 | 141.3° | 179.7° |
| C5 | N1 | C6 | N2 | 143.3° | 180.0° |
| C5 | N1 | C6 | H6 | 36.7° | 0.0° |
| C5 | N1 | C10 | C7 | 155.3° | 179.8° |
| C5 | N1 | C10 | N5 | 26.0° | 0.9° |
| H5 | C5 | N1 | C6 | 115.1° | 146.5° |
| H5 | C5 | N1 | C10 | 24.1° | 33.8° |
| N1 | C6 | N2 | H6 | 180.0° | 180.0° |
| N1 | C6 | N2 | C7 | 1.2° | 0.1° |
| C6 | N1 | C10 | C7 | 2.0° | 0.4° |
| C6 | N1 | C10 | N5 | 179.2° | 179.4° |
| C10 | N1 | C6 | N2 | 2.1° | 0.2° |
| C10 | N1 | C6 | H6 | 177.9° | 179.7° |
| N1 | C10 | C7 | N2 | 1.5° | 0.5° |
| N1 | C10 | C7 | C8 | 178.3° | 179.8° |
| N1 | C10 | C7 | N5 | 179.0° | 179.2° |
| N1 | C10 | N5 | C9 | 178.6° | 179.6° |
| C6 | N2 | C7 | C8 | 179.6° | 180.0° |
| C6 | N2 | C7 | C10 | 0.2° | 0.3° |
| H6 | C6 | N2 | C7 | 178.8° | 180.0° |
| N2 | C7 | C8 | C10 | 179.8° | 179.6° |
| N2 | C7 | C8 | N3 | 0.7° | 0.1° |
| N2 | C7 | C8 | N4 | 179.5° | 180.0° |
| N2 | C7 | C10 | N5 | 179.5° | 179.6° |
| C7 | C8 | N3 | N4 | 179.9° | 180.0° |
| C7 | C8 | N3 | HN31 | 179.9° | 0.0° |
| C7 | C8 | N3 | HN32 | 0.1° | 180.0° |
| C7 | C8 | N4 | C9 | 0.0° | 0.1° |
| C8 | C7 | C10 | N5 | 0.7° | 0.7° |
| C10 | C7 | C8 | N3 | 179.2° | 179.7° |
| C10 | C7 | C8 | N4 | 0.7° | 0.4° |
| C7 | C10 | N5 | C9 | 0.0° | 0.7° |
| C8 | N3 | HN31 | HN32 | 180.0° | 180.0° |
| N3 | C8 | N4 | C9 | 179.8° | 179.9° |
| N4 | C8 | N3 | HN31 | 0.1° | 180.0° |
| N4 | C8 | N3 | HN32 | 179.9° | 0.0° |
| C8 | N4 | C9 | N5 | 0.6° | 0.1° |
| C8 | N4 | C9 | H9 | 179.4° | 180.0° |
| N4 | C9 | N5 | H9 | 180.0° | 179.9° |
| N4 | C9 | N5 | C10 | 0.6° | 0.5° |
| H9 | C9 | N5 | C10 | 179.4° | 179.6° |
| O7 | P2 | O8 | O9 | 116.8° | 120.0° |
| O7 | P2 | O8 | O10 | 114.1° | 120.0° |
| O7 | P2 | O9 | O10 | 108.5° | 120.0° |
| O7 | P2 | O9 | HO9 | 60.8° | 60.0° |
| O7 | P2 | O10 | C11 | 119.4° | 175.0° |
| O8 | P2 | O9 | O10 | 129.1° | 120.0° |
| O8 | P2 | O9 | HO9 | 61.5° | 180.0° |
| O8 | P2 | O10 | C11 | 121.4° | 55.0° |
| O9 | P2 | O10 | C11 | 12.5° | 65.0° |
| O10 | P2 | O9 | HO9 | 169.3° | 60.0° |
| P2 | O10 | C11 | C12 | 136.7° | 180.0° |
| P2 | O10 | C11 | H111 | 17.9° | 60.0° |
| P2 | O10 | C11 | H112 | 103.3° | 60.0° |
| O10 | C11 | C12 | H111 | 118.9° | 120.0° |
| O10 | C11 | C12 | H112 | 120.0° | 120.0° |
| O10 | C11 | H111 | H112 | 119.3° | 120.1° |
| O10 | C11 | C12 | O11 | 64.6° | 66.5° |
| O10 | C11 | C12 | C13 | 54.3° | 175.7° |
| O10 | C11 | C12 | H12 | 170.6° | 54.5° |
| C12 | C11 | H111 | H112 | 119.3° | 119.9° |
| C11 | C12 | O11 | C13 | 127.1° | 119.4° |
| C11 | C12 | O11 | H12 | 116.1° | 121.0° |
| C11 | C12 | C13 | H12 | 115.7° | 121.1° |
| C11 | C12 | O11 | C15 | 129.4° | 145.9° |
| C11 | C12 | C13 | O12 | 140.4° | 119.9° |
| C11 | C12 | C13 | C14 | 94.7° | 121.4° |
| C11 | C12 | C13 | H1 | 28.0° | 2.6° |
| H111 | C11 | C12 | O11 | 54.3° | 53.5° |
| H111 | C11 | C12 | C13 | 173.2° | 64.3° |
| H111 | C11 | C12 | H12 | 70.5° | 174.5° |
| H112 | C11 | C12 | O11 | 175.4° | 173.5° |
| H112 | C11 | C12 | C13 | 65.7° | 55.7° |
| H112 | C11 | C12 | H12 | 50.6° | 65.5° |
| O11 | C12 | C13 | H12 | 124.9° | 119.5° |
| O11 | C12 | C13 | O12 | 100.2° | 120.7° |
| O11 | C12 | C13 | C14 | 24.7° | 2.0° |
| O11 | C12 | C13 | H1 | 147.4° | 116.8° |
| C12 | O11 | C15 | C14 | 28.7° | 40.0° |
| C12 | O11 | C15 | N6 | 150.5° | 158.5° |
| C12 | O11 | C15 | H15 | 92.8° | 78.5° |
| C13 | C12 | O11 | C15 | 2.2° | 26.5° |
| C12 | C13 | O12 | C14 | 118.0° | 114.8° |
| C12 | C13 | O12 | H1 | 120.1° | 122.6° |
| C12 | C13 | C14 | H1 | 121.0° | 118.7° |
| C12 | C13 | O12 | H7 | 52.6° | 179.9° |
| C12 | C13 | C14 | O13 | 169.2° | 139.1° |
| C12 | C13 | C14 | C15 | 40.3° | 20.9° |
| C12 | C13 | C14 | H14 | 85.6° | 97.4° |
| H12 | C12 | O11 | C15 | 114.5° | 93.1° |
| H12 | C12 | C13 | O12 | 24.7° | 1.2° |
| H12 | C12 | C13 | C14 | 149.6° | 117.5° |
| H12 | C12 | C13 | H1 | 87.7° | 123.8° |
| O11 | C15 | C14 | C13 | 44.1° | 37.0° |
| O11 | C15 | C14 | O13 | 179.3° | 155.2° |
| O11 | C15 | C14 | N6 | 123.0° | 118.5° |
| O11 | C15 | C14 | H15 | 120.3° | 118.5° |
| O11 | C15 | C14 | H14 | 73.5° | 81.2° |
| O11 | C15 | N6 | H15 | 120.1° | 122.9° |
| O11 | C15 | N6 | C16 | 54.2° | 126.4° |
| O11 | C15 | N6 | C21 | 125.9° | 53.3° |
| O12 | C13 | C14 | H1 | 112.5° | 122.6° |
| O12 | C13 | C14 | O13 | 42.7° | 20.4° |
| O12 | C13 | C14 | C15 | 86.2° | 97.8° |
| O12 | C13 | C14 | H14 | 147.9° | 144.0° |
| C14 | C13 | O12 | H7 | 170.6° | 65.3° |
| C13 | C14 | O13 | C15 | 123.0° | 112.7° |
| C13 | C14 | O13 | H14 | 113.2° | 123.7° |
| C13 | C14 | C15 | H14 | 117.6° | 118.3° |
| C13 | C14 | O13 | H13 | 38.1° | 61.5° |
| C13 | C14 | C15 | N6 | 167.1° | 155.5° |
| C13 | C14 | C15 | H15 | 76.2° | 81.4° |
| H1 | C13 | O12 | H7 | 67.4° | 57.4° |
| H1 | C13 | C14 | O13 | 69.8° | 102.2° |
| H1 | C13 | C14 | C15 | 161.3° | 139.6° |
| H1 | C13 | C14 | H14 | 35.4° | 21.3° |
| O13 | C14 | C15 | H14 | 107.2° | 123.5° |
| O13 | C14 | C15 | N6 | 57.7° | 86.3° |
| O13 | C14 | C15 | H15 | 59.0° | 36.8° |
| C15 | C14 | O13 | H13 | 84.9° | 174.2° |
| C14 | C15 | N6 | H15 | 121.4° | 123.0° |
| C14 | C15 | N6 | C16 | 64.3° | 119.5° |
| C14 | C15 | N6 | C21 | 115.7° | 60.8° |
| H14 | C14 | O13 | H13 | 151.3° | 62.2° |
| H14 | C14 | C15 | N6 | 49.5° | 37.2° |
| H14 | C14 | C15 | H15 | 166.2° | 160.3° |
| C15 | N6 | C16 | C21 | 179.9° | 179.7° |
| C15 | N6 | C16 | C17 | 178.8° | 162.5° |
| C15 | N6 | C16 | H16 | 1.1° | 17.5° |
| C15 | N6 | C21 | C20 | 178.7° | 162.0° |
| C15 | N6 | C21 | H21 | 1.3° | 17.8° |
| H15 | C15 | N6 | C16 | 174.3° | 3.5° |
| H15 | C15 | N6 | C21 | 5.7° | 176.2° |
| N6 | C16 | C17 | H16 | 180.0° | 179.9° |
| N6 | C16 | C17 | C18 | 179.4° | 179.6° |
| N6 | C16 | C17 | C19 | 0.7° | 0.4° |
| C16 | N6 | C21 | C20 | 1.2° | 18.3° |
| C16 | N6 | C21 | H21 | 178.8° | 161.9° |
| C21 | N6 | C16 | C17 | 1.1° | 17.8° |
| C21 | N6 | C16 | H16 | 178.9° | 162.2° |
| N6 | C21 | C20 | C19 | 0.5° | 0.2° |
| N6 | C21 | C20 | H21 | 180.0° | 179.8° |
| N6 | C21 | C20 | H20 | 179.5° | 180.0° |
| C16 | C17 | C18 | C19 | 179.8° | 180.0° |
| C16 | C17 | C18 | O14 | 0.2° | 6.6° |
| C16 | C17 | C18 | N7 | 179.8° | 173.5° |
| C16 | C17 | C19 | C20 | 2.3° | 16.1° |
| C16 | C17 | C19 | C22 | 111.5° | 136.5° |
| C16 | C17 | C19 | H19 | 122.9° | 104.2° |
| H16 | C16 | C17 | C18 | 0.6° | 0.5° |
| H16 | C16 | C17 | C19 | 179.3° | 179.5° |
| C17 | C18 | O14 | N7 | 179.6° | 180.0° |
| C17 | C18 | N7 | HN71 | 179.9° | 5.4° |
| C17 | C18 | N7 | HN72 | 0.1° | 174.6° |
| C18 | C17 | C19 | C20 | 177.8° | 163.8° |
| C18 | C17 | C19 | C22 | 68.4° | 43.5° |
| C18 | C17 | C19 | H19 | 57.3° | 75.8° |
| C19 | C17 | C18 | O14 | 180.0° | 173.4° |
| C19 | C17 | C18 | N7 | 0.3° | 6.6° |
| C17 | C19 | C20 | C22 | 119.4° | 120.4° |
| C17 | C19 | C20 | H19 | 115.1° | 120.4° |
| C17 | C19 | C22 | H19 | 115.0° | 119.3° |
| C17 | C19 | C20 | C21 | 2.3° | 15.9° |
| C17 | C19 | C20 | H20 | 177.7° | 163.9° |
| C17 | C19 | C22 | O15 | 25.3° | 30.0° |
| C17 | C19 | C22 | C25 | 156.5° | 150.0° |
| O14 | C18 | N7 | HN71 | 0.3° | 174.6° |
| O14 | C18 | N7 | HN72 | 179.8° | 5.4° |
| C18 | N7 | HN71 | HN72 | 180.0° | 180.0° |
| C20 | C19 | C22 | H19 | 120.3° | 119.3° |
| C19 | C20 | C21 | H20 | 180.0° | 179.7° |
| C19 | C20 | C21 | H21 | 179.4° | 180.0° |
| C20 | C19 | C22 | O15 | 99.4° | 91.4° |
| C20 | C19 | C22 | C25 | 78.8° | 88.6° |
| C22 | C19 | C20 | C21 | 117.1° | 136.2° |
| C22 | C19 | C20 | H20 | 62.9° | 43.5° |
| C19 | C22 | O15 | C25 | 178.4° | 180.0° |
| C19 | C22 | C25 | C24 | 1.4° | 0.0° |
| C19 | C22 | C25 | C26 | 177.6° | 180.0° |
| H19 | C19 | C20 | C21 | 117.4° | 104.5° |
| H19 | C19 | C20 | H20 | 62.6° | 75.7° |
| H19 | C19 | C22 | O15 | 140.3° | 149.3° |
| H19 | C19 | C22 | C25 | 41.5° | 30.7° |
| H20 | C20 | C21 | H21 | 0.5° | 0.2° |
| O15 | C22 | C25 | C24 | 179.7° | 180.0° |
| O15 | C22 | C25 | C26 | 0.6° | 0.1° |
| C22 | C25 | C24 | C23 | 179.1° | 180.0° |
| C22 | C25 | C24 | C26 | 179.1° | 179.9° |
| C22 | C25 | C24 | H24 | 0.9° | 0.1° |
| C22 | C25 | C26 | C27 | 178.7° | 179.9° |
| C22 | C25 | C26 | H26 | 1.2° | 0.0° |
| N8 | C23 | C24 | H23 | 180.0° | 179.9° |
| N8 | C23 | C24 | C25 | 0.4° | 0.1° |
| N8 | C23 | C24 | H24 | 179.6° | 180.0° |
| C23 | N8 | C27 | C26 | 0.0° | 0.0° |
| C23 | N8 | C27 | C28 | 179.6° | 179.9° |
| C27 | N8 | C23 | C24 | 0.4° | 0.1° |
| C27 | N8 | C23 | H23 | 179.6° | 180.0° |
| N8 | C27 | C26 | C25 | 0.4° | 0.0° |
| N8 | C27 | C26 | C28 | 179.5° | 180.0° |
| N8 | C27 | C26 | H26 | 179.6° | 179.9° |
| N8 | C27 | C28 | C29 | 42.8° | 55.0° |
| N8 | C27 | C28 | H281 | 75.1° | 65.0° |
| N8 | C27 | C28 | H282 | 162.8° | 175.0° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.0° | 0.1° |
| H23 | C23 | C24 | C25 | 179.6° | 180.0° |
| H23 | C23 | C24 | H24 | 0.4° | 0.1° |
| C24 | C25 | C26 | C27 | 0.4° | 0.0° |
| C24 | C25 | C26 | H26 | 179.7° | 179.9° |
| H24 | C24 | C25 | C26 | 180.0° | 180.0° |
| C25 | C26 | C27 | H26 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 179.1° | 180.0° |
| C26 | C27 | C28 | C29 | 137.7° | 124.9° |
| C26 | C27 | C28 | H281 | 104.5° | 115.1° |
| C26 | C27 | C28 | H282 | 17.7° | 5.0° |
| H26 | C26 | C27 | C28 | 0.8° | 0.1° |
| C27 | C28 | C29 | H281 | 117.9° | 120.0° |
| C27 | C28 | C29 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H282 | 118.7° | 120.0° |
| C27 | C28 | C29 | H291 | 125.0° | 60.0° |
| C27 | C28 | C29 | H292 | 5.0° | 60.0° |
| C27 | C28 | C29 | H293 | 115.0° | 180.0° |
| C29 | C28 | H281 | H282 | 118.6° | 120.0° |
| C28 | C29 | H291 | H292 | 120.0° | 120.0° |
| C28 | C29 | H291 | H293 | 120.1° | 119.9° |
| C28 | C29 | H292 | H293 | 120.0° | 119.9° |
| H281 | C28 | C29 | H291 | 117.2° | 180.0° |
| H281 | C28 | C29 | H292 | 122.9° | 60.0° |
| H281 | C28 | C29 | H293 | 2.9° | 60.0° |
| H282 | C28 | C29 | H291 | 5.0° | 59.9° |
| H282 | C28 | C29 | H292 | 115.0° | 180.0° |
| H282 | C28 | C29 | H293 | 125.0° | 60.1° |
| H291 | C29 | H292 | H293 | 120.0° | 120.1° |
