ZSI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | sing | 1.51Å | 1.50Å | |
| O2 | C10 | sing | 1.43Å | 1.38Å | |
| C13 | C12 | doub | 1.38Å | 1.36Å | Aromatic |
| C13 | C15 | sing | 1.38Å | 1.43Å | Aromatic |
| C12 | C11 | sing | 1.39Å | 1.37Å | Aromatic |
| C10 | C9 | sing | 1.55Å | 1.51Å | |
| C10 | N2 | sing | 1.49Å | 1.44Å | |
| C9 | C8 | sing | 1.55Å | 1.51Å | |
| C16 | C15 | sing | 1.51Å | 1.50Å | |
| C15 | C17 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | N2 | sing | 1.40Å | 1.36Å | |
| C11 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
| N2 | C37 | sing | 1.48Å | 1.45Å | |
| O17 | C36 | doub | 1.21Å | 1.20Å | |
| C8 | C37 | sing | 1.54Å | 1.56Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C17 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
| C18 | N3 | sing | 1.40Å | 1.40Å | |
| C37 | C36 | sing | 1.50Å | 1.49Å | |
| C37 | C34 | sing | 1.50Å | 1.50Å | |
| C36 | N10 | sing | 1.34Å | 1.32Å | |
| C7 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C38 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C38 | C3 | doub | 1.40Å | 1.39Å | Aromatic |
| N3 | C34 | sing | 1.36Å | 1.35Å | |
| N3 | C19 | sing | 1.47Å | 1.48Å | |
| C34 | N9 | doub | 1.31Å | 1.28Å | |
| N10 | C35 | sing | 1.34Å | 1.35Å | |
| C5 | C4 | doub | 1.38Å | 1.37Å | Aromatic |
| C3 | C4 | sing | 1.40Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.48Å | 1.49Å | |
| O3 | C20 | sing | 1.43Å | 1.37Å | |
| N1 | C2 | sing | 1.35Å | 1.31Å | |
| N1 | C1 | sing | 1.47Å | 1.45Å | |
| C19 | C20 | sing | 1.53Å | 1.49Å | |
| N9 | C35 | sing | 1.34Å | 1.29Å | |
| C2 | O1 | doub | 1.22Å | 1.22Å | |
| C35 | O16 | doub | 1.22Å | 1.20Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| O14 | C32 | sing | 1.43Å | 1.40Å | |
| C21 | O4 | sing | 1.43Å | 1.38Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C32 | C33 | sing | 1.55Å | 1.52Å | |
| C32 | C26 | sing | 1.55Å | 1.51Å | |
| O10 | P2 | doub | 1.48Å | 1.45Å | |
| O5 | C22 | sing | 1.43Å | 1.41Å | |
| C27 | N5 | doub | 1.30Å | 1.30Å | Aromatic |
| C27 | N4 | sing | 1.36Å | 1.32Å | Aromatic |
| C33 | O15 | sing | 1.43Å | 1.41Å | |
| C33 | C25 | sing | 1.54Å | 1.52Å | |
| N5 | C28 | sing | 1.35Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.53Å | 1.51Å | |
| O11 | P2 | sing | 1.61Å | 1.45Å | |
| N4 | C26 | sing | 1.47Å | 1.40Å | |
| N4 | C31 | sing | 1.37Å | 1.35Å | Aromatic |
| P2 | O12 | sing | 1.61Å | 1.55Å | |
| P2 | O9 | sing | 1.61Å | 1.56Å | |
| C26 | O13 | sing | 1.44Å | 1.39Å | |
| C28 | C31 | doub | 1.41Å | 1.36Å | Aromatic |
| C28 | C29 | sing | 1.41Å | 1.40Å | Aromatic |
| C23 | O6 | sing | 1.43Å | 1.43Å | |
| N6 | C29 | sing | 1.38Å | 1.32Å | |
| C31 | N8 | sing | 1.33Å | 1.33Å | Aromatic |
| C29 | N7 | doub | 1.33Å | 1.34Å | Aromatic |
| O12 | C24 | sing | 1.43Å | 1.41Å | |
| C25 | O13 | sing | 1.44Å | 1.43Å | |
| C25 | C24 | sing | 1.53Å | 1.50Å | |
| O6 | P1 | sing | 1.61Å | 1.55Å | |
| O9 | P1 | sing | 1.61Å | 1.56Å | |
| N8 | C30 | doub | 1.32Å | 1.32Å | Aromatic |
| N7 | C30 | sing | 1.32Å | 1.33Å | Aromatic |
| P1 | O8 | doub | 1.48Å | 1.45Å | |
| P1 | O7 | sing | 1.61Å | 1.45Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| N1 | H12 | sing | 0.97Å | 1.00Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.08Å | 1.08Å | |
| C30 | H32 | sing | 1.08Å | 1.08Å | |
| C32 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H34 | sing | 1.09Å | 1.10Å | |
| C38 | H36 | sing | 1.08Å | 1.08Å | |
| N10 | H37 | sing | 0.97Å | 1.00Å | |
| N6 | H38 | sing | 0.97Å | 1.00Å | |
| N6 | H39 | sing | 0.97Å | 1.00Å | |
| O11 | H41 | sing | 0.97Å | 0.95Å | |
| O14 | H42 | sing | 0.97Å | 0.95Å | |
| O15 | H43 | sing | 0.97Å | 0.95Å | |
| O2 | H44 | sing | 0.97Å | 0.95Å | |
| O3 | H45 | sing | 0.97Å | 0.95Å | |
| O4 | H46 | sing | 0.97Å | 0.95Å | |
| O5 | H47 | sing | 0.97Å | 0.95Å | |
| O7 | H48 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C13 | C12 | 120.4° | 119.9° |
| C14 | C13 | C15 | 120.5° | 119.9° |
| C13 | C14 | H2 | 109.5° | 109.5° |
| C13 | C14 | H3 | 109.5° | 109.5° |
| C13 | C14 | H4 | 109.4° | 109.5° |
| O2 | C10 | C9 | 111.1° | 110.5° |
| O2 | C10 | N2 | 107.1° | 110.5° |
| O2 | C10 | H10 | 112.5° | 110.5° |
| C10 | O2 | H44 | 109.5° | 114.0° |
| C12 | C13 | C15 | 119.1° | 120.3° |
| C13 | C12 | C11 | 120.3° | 120.2° |
| C13 | C12 | H11 | 119.9° | 119.9° |
| C13 | C15 | C16 | 119.0° | 120.0° |
| C13 | C15 | C17 | 119.9° | 120.0° |
| C12 | C11 | N2 | 115.7° | 118.3° |
| C12 | C11 | C18 | 121.3° | 119.3° |
| C11 | C12 | H11 | 119.9° | 119.9° |
| C9 | C10 | N2 | 103.6° | 104.2° |
| C10 | C9 | C8 | 96.8° | 104.9° |
| C10 | C9 | H8 | 112.6° | 110.4° |
| C10 | C9 | H9 | 112.5° | 110.5° |
| C9 | C10 | H10 | 110.5° | 110.5° |
| C10 | N2 | C11 | 110.5° | 107.7° |
| C10 | N2 | C37 | 108.7° | 103.4° |
| N2 | C10 | H10 | 111.6° | 110.5° |
| C9 | C8 | C37 | 104.1° | 104.5° |
| C9 | C8 | C7 | 117.8° | 110.4° |
| C9 | C8 | H7 | 102.2° | 110.5° |
| C8 | C9 | H8 | 112.5° | 110.3° |
| C8 | C9 | H9 | 112.6° | 110.4° |
| C16 | C15 | C17 | 121.1° | 120.0° |
| C15 | C16 | H16 | 109.5° | 109.5° |
| C15 | C16 | H17 | 109.5° | 109.5° |
| C15 | C16 | H18 | 109.4° | 109.5° |
| C15 | C17 | C18 | 120.2° | 120.0° |
| C15 | C17 | H19 | 119.9° | 120.0° |
| N2 | C11 | C18 | 122.9° | 122.3° |
| C11 | N2 | C37 | 121.4° | 111.9° |
| C11 | C18 | C17 | 119.3° | 120.2° |
| C11 | C18 | N3 | 118.9° | 120.5° |
| N2 | C37 | C8 | 102.6° | 104.8° |
| N2 | C37 | C36 | 106.6° | 110.4° |
| N2 | C37 | C34 | 112.2° | 111.4° |
| O17 | C36 | C37 | 122.1° | 119.7° |
| O17 | C36 | N10 | 121.8° | 119.7° |
| C37 | C8 | C7 | 125.0° | 110.5° |
| C8 | C37 | C36 | 100.6° | 108.8° |
| C8 | C37 | C34 | 126.1° | 110.4° |
| C37 | C8 | H7 | 101.9° | 110.4° |
| C8 | C7 | C6 | 114.1° | 119.9° |
| C8 | C7 | C38 | 126.9° | 119.9° |
| C7 | C8 | H7 | 102.2° | 110.4° |
| C17 | C18 | N3 | 121.9° | 119.3° |
| C18 | C17 | H19 | 119.9° | 120.0° |
| C18 | N3 | C34 | 120.7° | 118.2° |
| C18 | N3 | C19 | 119.2° | 121.0° |
| C36 | C37 | C34 | 106.9° | 110.8° |
| C37 | C36 | N10 | 116.1° | 120.6° |
| C37 | C34 | N3 | 121.7° | 118.8° |
| C37 | C34 | N9 | 119.9° | 121.4° |
| C36 | N10 | C35 | 121.4° | 121.1° |
| C36 | N10 | H37 | 119.3° | 119.5° |
| C6 | C7 | C38 | 119.0° | 120.2° |
| C7 | C6 | C5 | 121.3° | 120.3° |
| C7 | C6 | H6 | 119.3° | 119.9° |
| C7 | C38 | C3 | 119.8° | 119.8° |
| C7 | C38 | H36 | 120.1° | 120.1° |
| C6 | C5 | C4 | 119.6° | 120.2° |
| C6 | C5 | H5 | 120.2° | 119.9° |
| C5 | C6 | H6 | 119.3° | 119.8° |
| C38 | C3 | C4 | 120.0° | 119.7° |
| C38 | C3 | C2 | 128.2° | 120.1° |
| C3 | C38 | H36 | 120.1° | 120.1° |
| C34 | N3 | C19 | 120.0° | 120.9° |
| N3 | C34 | N9 | 118.3° | 119.8° |
| N3 | C19 | C20 | 114.4° | 109.5° |
| N3 | C19 | H20 | 108.2° | 109.4° |
| N3 | C19 | H21 | 108.2° | 109.4° |
| C34 | N9 | C35 | 117.9° | 122.2° |
| N10 | C35 | N9 | 123.7° | 121.8° |
| N10 | C35 | O16 | 117.8° | 119.1° |
| C35 | N10 | H37 | 119.3° | 119.4° |
| C5 | C4 | C3 | 120.3° | 119.8° |
| C5 | C4 | H1 | 119.9° | 120.1° |
| C4 | C5 | H5 | 120.2° | 119.9° |
| C4 | C3 | C2 | 111.8° | 120.1° |
| C3 | C4 | H1 | 119.9° | 120.1° |
| C3 | C2 | N1 | 119.1° | 120.0° |
| C3 | C2 | O1 | 120.5° | 120.0° |
| O3 | C20 | C19 | 105.3° | 109.5° |
| O3 | C20 | C21 | 107.2° | 109.5° |
| O3 | C20 | H22 | 112.3° | 109.5° |
| C20 | O3 | H45 | 109.5° | 114.0° |
| C2 | N1 | C1 | 119.9° | 120.0° |
| N1 | C2 | O1 | 120.3° | 120.1° |
| C2 | N1 | H12 | 120.0° | 120.0° |
| C1 | N1 | H12 | 120.1° | 120.0° |
| N1 | C1 | H13 | 109.5° | 109.5° |
| N1 | C1 | H14 | 109.5° | 109.5° |
| N1 | C1 | H15 | 109.5° | 109.5° |
| C19 | C20 | C21 | 111.7° | 109.4° |
| C20 | C19 | H20 | 108.2° | 109.5° |
| C20 | C19 | H21 | 108.2° | 109.5° |
| C19 | C20 | H22 | 110.3° | 109.5° |
| N9 | C35 | O16 | 118.5° | 119.1° |
| C20 | C21 | O4 | 109.3° | 109.5° |
| C20 | C21 | C22 | 115.2° | 109.4° |
| C21 | C20 | H22 | 109.9° | 109.5° |
| C20 | C21 | H23 | 107.7° | 109.5° |
| O14 | C32 | C33 | 111.7° | 110.9° |
| O14 | C32 | C26 | 109.6° | 110.9° |
| O14 | C32 | H33 | 112.6° | 110.8° |
| C32 | O14 | H42 | 109.5° | 114.0° |
| O4 | C21 | C22 | 107.2° | 109.5° |
| O4 | C21 | H23 | 109.6° | 109.5° |
| C21 | O4 | H46 | 109.5° | 114.0° |
| C21 | C22 | O5 | 107.7° | 109.5° |
| C21 | C22 | C23 | 112.2° | 109.5° |
| C22 | C21 | H23 | 107.7° | 109.5° |
| C21 | C22 | H24 | 108.7° | 109.5° |
| C33 | C32 | C26 | 100.5° | 102.1° |
| C32 | C33 | O15 | 111.8° | 110.5° |
| C32 | C33 | C25 | 104.4° | 104.2° |
| C33 | C32 | H33 | 110.8° | 110.9° |
| C32 | C33 | H34 | 110.2° | 110.6° |
| C32 | C26 | N4 | 115.2° | 110.7° |
| C32 | C26 | O13 | 102.8° | 103.5° |
| C32 | C26 | H30 | 109.3° | 110.6° |
| C26 | C32 | H33 | 111.0° | 110.9° |
| O10 | P2 | O11 | 121.3° | 109.5° |
| O10 | P2 | O12 | 109.4° | 109.4° |
| O10 | P2 | O9 | 109.4° | 109.5° |
| O5 | C22 | C23 | 109.2° | 109.5° |
| O5 | C22 | H24 | 110.1° | 109.5° |
| C22 | O5 | H47 | 109.5° | 114.0° |
| N5 | C27 | N4 | 113.6° | 110.0° |
| C27 | N5 | C28 | 103.9° | 109.4° |
| N5 | C27 | H31 | 123.2° | 125.0° |
| C27 | N4 | C26 | 128.2° | 126.3° |
| C27 | N4 | C31 | 107.1° | 107.5° |
| N4 | C27 | H31 | 123.2° | 125.0° |
| O15 | C33 | C25 | 108.1° | 110.4° |
| O15 | C33 | H34 | 111.9° | 110.6° |
| C33 | O15 | H43 | 109.5° | 114.0° |
| C33 | C25 | O13 | 104.7° | 107.3° |
| C33 | C25 | C24 | 114.9° | 109.8° |
| C33 | C25 | H29 | 109.1° | 110.0° |
| C25 | C33 | H34 | 110.1° | 110.5° |
| N5 | C28 | C31 | 109.7° | 107.2° |
| N5 | C28 | C29 | 133.5° | 134.7° |
| C22 | C23 | O6 | 114.1° | 109.5° |
| C23 | C22 | H24 | 108.9° | 109.4° |
| C22 | C23 | H25 | 108.3° | 109.5° |
| C22 | C23 | H26 | 108.3° | 109.4° |
| O11 | P2 | O12 | 106.7° | 109.5° |
| O11 | P2 | O9 | 106.6° | 109.5° |
| P2 | O11 | H41 | 109.5° | 114.0° |
| C26 | N4 | C31 | 124.7° | 126.2° |
| N4 | C26 | O13 | 107.2° | 110.6° |
| N4 | C26 | H30 | 110.9° | 110.6° |
| N4 | C31 | C28 | 105.7° | 106.0° |
| N4 | C31 | N8 | 126.9° | 135.0° |
| O12 | P2 | O9 | 101.6° | 109.5° |
| P2 | O12 | C24 | 117.3° | 123.0° |
| P2 | O9 | P1 | 128.6° | 134.0° |
| C26 | O13 | C25 | 107.0° | 106.9° |
| O13 | C26 | H30 | 111.1° | 110.6° |
| C31 | C28 | C29 | 116.9° | 118.1° |
| C28 | C31 | N8 | 127.4° | 119.1° |
| C28 | C29 | N6 | 124.2° | 120.7° |
| C28 | C29 | N7 | 117.4° | 118.5° |
| C23 | O6 | P1 | 118.7° | 123.0° |
| O6 | C23 | H25 | 108.3° | 109.5° |
| O6 | C23 | H26 | 108.3° | 109.4° |
| N6 | C29 | N7 | 118.3° | 120.8° |
| C29 | N6 | H38 | 109.5° | 120.0° |
| C29 | N6 | H39 | 109.4° | 120.0° |
| C31 | N8 | C30 | 110.5° | 120.7° |
| C29 | N7 | C30 | 118.8° | 121.1° |
| O12 | C24 | C25 | 107.9° | 109.5° |
| O12 | C24 | H27 | 109.9° | 109.5° |
| O12 | C24 | H28 | 109.9° | 109.5° |
| O13 | C25 | C24 | 108.0° | 109.9° |
| O13 | C25 | H29 | 110.4° | 109.9° |
| C25 | C24 | H27 | 109.9° | 109.5° |
| C25 | C24 | H28 | 109.9° | 109.5° |
| C24 | C25 | H29 | 109.5° | 109.9° |
| O6 | P1 | O9 | 101.2° | 109.5° |
| O6 | P1 | O8 | 110.5° | 109.5° |
| O6 | P1 | O7 | 104.8° | 109.5° |
| O9 | P1 | O8 | 109.8° | 109.5° |
| O9 | P1 | O7 | 111.3° | 109.4° |
| N8 | C30 | N7 | 129.0° | 122.5° |
| N8 | C30 | H32 | 115.5° | 118.8° |
| N7 | C30 | H32 | 115.5° | 118.7° |
| O8 | P1 | O7 | 117.9° | 109.4° |
| P1 | O7 | H48 | 109.5° | 114.0° |
| H2 | C14 | H3 | 109.4° | 109.4° |
| H2 | C14 | H4 | 109.5° | 109.5° |
| H3 | C14 | H4 | 109.5° | 109.5° |
| H8 | C9 | H9 | 109.4° | 110.2° |
| H13 | C1 | H14 | 109.5° | 109.4° |
| H13 | C1 | H15 | 109.4° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H16 | C16 | H17 | 109.5° | 109.5° |
| H16 | C16 | H18 | 109.5° | 109.5° |
| H17 | C16 | H18 | 109.5° | 109.4° |
| H20 | C19 | H21 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H27 | C24 | H28 | 109.5° | 109.5° |
| H38 | N6 | H39 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C13 | C12 | C15 | 179.3° | 179.9° |
| C14 | C13 | C12 | C11 | 179.8° | 179.9° |
| C14 | C13 | C15 | C16 | 0.7° | 0.1° |
| C14 | C13 | C15 | C17 | 179.8° | 180.0° |
| C13 | C14 | H2 | H3 | 120.0° | 120.0° |
| C13 | C14 | H2 | H4 | 120.0° | 120.1° |
| C13 | C14 | H3 | H4 | 120.0° | 120.1° |
| C14 | C13 | C12 | H11 | 0.2° | 0.0° |
| O2 | C10 | C9 | N2 | 114.8° | 118.7° |
| O2 | C10 | C9 | H10 | 125.6° | 122.6° |
| O2 | C10 | N2 | H10 | 123.6° | 122.7° |
| O2 | C10 | C9 | C8 | 67.0° | 94.3° |
| O2 | C10 | N2 | C11 | 142.5° | 163.9° |
| O2 | C10 | N2 | C37 | 82.0° | 77.6° |
| O2 | C10 | C9 | H8 | 50.9° | 146.9° |
| O2 | C10 | C9 | H9 | 175.2° | 24.7° |
| C13 | C12 | C11 | H11 | 180.0° | 180.0° |
| C12 | C13 | C15 | C16 | 180.0° | 180.0° |
| C12 | C13 | C15 | C17 | 0.5° | 0.0° |
| C13 | C12 | C11 | N2 | 179.8° | 179.8° |
| C13 | C12 | C11 | C18 | 0.1° | 0.2° |
| C12 | C13 | C14 | H2 | 89.7° | 90.1° |
| C12 | C13 | C14 | H3 | 150.4° | 150.0° |
| C12 | C13 | C14 | H4 | 30.4° | 30.0° |
| C15 | C13 | C12 | C11 | 0.5° | 0.0° |
| C13 | C15 | C16 | C17 | 179.5° | 180.0° |
| C13 | C15 | C17 | C18 | 0.1° | 0.2° |
| C15 | C13 | C14 | H2 | 89.6° | 90.0° |
| C15 | C13 | C14 | H3 | 30.3° | 29.9° |
| C15 | C13 | C14 | H4 | 150.3° | 150.0° |
| C15 | C13 | C12 | H11 | 179.5° | 180.0° |
| C13 | C15 | C16 | H16 | 90.3° | 90.0° |
| C13 | C15 | C16 | H17 | 149.7° | 150.0° |
| C13 | C15 | C16 | H18 | 29.7° | 30.0° |
| C13 | C15 | C17 | H19 | 179.9° | 180.0° |
| C12 | C11 | N2 | C10 | 42.5° | 40.5° |
| C12 | C11 | N2 | C18 | 179.8° | 179.6° |
| C12 | C11 | N2 | C37 | 171.5° | 153.4° |
| C12 | C11 | C18 | C17 | 0.3° | 0.4° |
| C12 | C11 | C18 | N3 | 179.5° | 179.9° |
| C9 | C10 | N2 | H10 | 118.9° | 118.7° |
| C10 | C9 | C8 | H8 | 117.9° | 118.9° |
| C10 | C9 | C8 | H9 | 117.9° | 119.0° |
| C9 | C10 | N2 | C11 | 100.0° | 77.4° |
| C9 | C10 | N2 | C37 | 35.6° | 41.1° |
| C10 | C9 | C8 | C37 | 42.9° | 0.6° |
| C10 | C9 | C8 | C7 | 174.0° | 118.2° |
| C10 | C9 | C8 | H7 | 62.9° | 119.3° |
| C10 | C9 | H8 | H9 | 125.9° | 122.3° |
| C9 | C10 | O2 | H44 | 93.0° | 61.4° |
| N2 | C10 | C9 | C8 | 47.8° | 24.4° |
| C10 | N2 | C11 | C37 | 129.0° | 112.9° |
| C10 | N2 | C11 | C18 | 137.3° | 139.8° |
| C10 | N2 | C37 | C8 | 7.2° | 41.7° |
| C10 | N2 | C37 | C36 | 98.0° | 75.3° |
| C10 | N2 | C37 | C34 | 145.2° | 161.1° |
| N2 | C10 | C9 | H8 | 165.7° | 94.4° |
| N2 | C10 | C9 | H9 | 70.1° | 143.4° |
| N2 | C10 | O2 | H44 | 19.5° | 176.2° |
| C9 | C8 | C37 | N2 | 23.6° | 25.7° |
| C9 | C8 | C37 | C7 | 139.7° | 118.8° |
| C9 | C8 | C37 | H7 | 106.0° | 118.8° |
| C9 | C8 | C7 | H7 | 111.0° | 122.5° |
| C9 | C8 | C37 | C36 | 133.5° | 92.4° |
| C9 | C8 | C37 | C34 | 106.3° | 145.8° |
| C9 | C8 | C7 | C6 | 132.5° | 35.6° |
| C9 | C8 | C7 | C38 | 44.2° | 144.3° |
| C8 | C9 | H8 | H9 | 126.0° | 122.1° |
| C8 | C9 | C10 | H10 | 167.4° | 143.1° |
| C16 | C15 | C17 | C18 | 179.6° | 179.8° |
| C15 | C16 | H16 | H17 | 120.0° | 120.0° |
| C15 | C16 | H16 | H18 | 120.0° | 120.0° |
| C15 | C16 | H17 | H18 | 120.0° | 120.0° |
| C16 | C15 | C17 | H19 | 0.4° | 0.0° |
| C15 | C17 | C18 | C11 | 0.3° | 0.3° |
| C15 | C17 | C18 | H19 | 180.0° | 179.8° |
| C15 | C17 | C18 | N3 | 179.5° | 179.9° |
| C17 | C15 | C16 | H16 | 90.3° | 90.0° |
| C17 | C15 | C16 | H17 | 29.7° | 30.0° |
| C17 | C15 | C16 | H18 | 149.7° | 150.0° |
| C11 | N2 | C37 | C8 | 122.5° | 73.9° |
| N2 | C11 | C18 | C17 | 179.9° | 180.0° |
| N2 | C11 | C18 | N3 | 0.3° | 0.3° |
| C11 | N2 | C37 | C36 | 132.2° | 169.1° |
| C11 | N2 | C37 | C34 | 15.4° | 45.5° |
| C11 | N2 | C10 | H10 | 18.9° | 41.2° |
| N2 | C11 | C12 | H11 | 0.3° | 0.2° |
| C18 | C11 | N2 | C37 | 8.3° | 26.9° |
| C11 | C18 | C17 | N3 | 179.8° | 179.7° |
| C11 | C18 | N3 | C34 | 1.5° | 5.5° |
| C11 | C18 | N3 | C19 | 175.1° | 174.5° |
| C18 | C11 | C12 | H11 | 179.9° | 179.8° |
| C11 | C18 | C17 | H19 | 179.7° | 179.8° |
| N2 | C37 | C36 | O17 | 26.8° | 43.6° |
| N2 | C37 | C8 | C36 | 109.9° | 118.1° |
| N2 | C37 | C8 | C34 | 129.9° | 120.0° |
| N2 | C37 | C8 | C7 | 163.3° | 93.0° |
| N2 | C37 | C36 | C34 | 120.2° | 123.9° |
| N2 | C37 | C36 | N10 | 154.4° | 136.5° |
| N2 | C37 | C34 | N3 | 16.7° | 42.7° |
| N2 | C37 | C34 | N9 | 160.1° | 138.5° |
| N2 | C37 | C8 | H7 | 82.4° | 144.6° |
| C37 | N2 | C10 | H10 | 154.5° | 159.8° |
| O17 | C36 | C37 | C8 | 79.8° | 70.9° |
| O17 | C36 | C37 | N10 | 178.7° | 180.0° |
| O17 | C36 | C37 | C34 | 147.0° | 167.4° |
| O17 | C36 | N10 | C35 | 169.3° | 177.9° |
| O17 | C36 | N10 | H37 | 10.7° | 2.0° |
| C37 | C8 | C7 | H7 | 114.1° | 122.4° |
| C8 | C37 | C36 | C34 | 133.1° | 121.6° |
| C8 | C37 | C36 | N10 | 98.9° | 109.1° |
| C37 | C8 | C7 | C6 | 92.7° | 79.5° |
| C37 | C8 | C7 | C38 | 90.6° | 100.6° |
| C8 | C37 | C34 | N3 | 109.3° | 73.3° |
| C8 | C37 | C34 | N9 | 73.9° | 105.5° |
| C37 | C8 | C9 | H8 | 160.7° | 119.5° |
| C37 | C8 | C9 | H9 | 75.0° | 118.5° |
| C7 | C8 | C37 | C36 | 86.8° | 148.8° |
| C7 | C8 | C37 | C34 | 33.4° | 27.0° |
| C8 | C7 | C6 | C38 | 177.0° | 179.9° |
| C8 | C7 | C6 | C5 | 179.0° | 180.0° |
| C8 | C7 | C38 | C3 | 178.7° | 179.7° |
| C8 | C7 | C6 | H6 | 1.0° | 0.1° |
| C7 | C8 | C9 | H8 | 56.1° | 0.7° |
| C7 | C8 | C9 | H9 | 68.2° | 122.8° |
| C8 | C7 | C38 | H36 | 1.3° | 0.1° |
| C17 | C18 | N3 | C34 | 178.6° | 174.2° |
| C17 | C18 | N3 | C19 | 4.7° | 5.8° |
| C18 | N3 | C34 | C37 | 10.4° | 16.7° |
| C18 | N3 | C34 | C19 | 176.6° | 180.0° |
| C18 | N3 | C34 | N9 | 166.4° | 164.5° |
| C18 | N3 | C19 | C20 | 85.4° | 139.6° |
| N3 | C18 | C17 | H19 | 0.5° | 0.1° |
| C18 | N3 | C19 | H20 | 153.9° | 19.6° |
| C18 | N3 | C19 | H21 | 35.3° | 100.3° |
| C36 | C37 | C34 | N3 | 133.3° | 166.1° |
| C36 | C37 | C34 | N9 | 43.5° | 15.1° |
| C37 | C36 | N10 | C35 | 12.0° | 2.1° |
| C36 | C37 | C8 | H7 | 27.5° | 26.4° |
| C37 | C36 | N10 | H37 | 168.1° | 177.9° |
| C34 | C37 | C36 | N10 | 34.2° | 12.6° |
| C37 | C34 | N3 | N9 | 176.8° | 178.8° |
| C37 | C34 | N3 | C19 | 166.1° | 163.3° |
| C37 | C34 | N9 | C35 | 26.6° | 7.0° |
| C34 | C37 | C8 | H7 | 147.7° | 95.4° |
| C36 | N10 | C35 | H37 | 180.0° | 180.0° |
| C36 | N10 | C35 | N9 | 9.5° | 8.0° |
| C36 | N10 | C35 | O16 | 171.5° | 172.1° |
| C7 | C6 | C5 | H6 | 180.0° | 179.9° |
| C6 | C7 | C38 | C3 | 2.1° | 0.2° |
| C7 | C6 | C5 | C4 | 1.0° | 0.1° |
| C7 | C6 | C5 | H5 | 179.0° | 179.9° |
| C6 | C7 | C8 | H7 | 21.5° | 158.1° |
| C6 | C7 | C38 | H36 | 178.0° | 180.0° |
| C38 | C7 | C6 | C5 | 2.0° | 0.1° |
| C7 | C38 | C3 | H36 | 180.0° | 179.8° |
| C7 | C38 | C3 | C4 | 1.2° | 0.5° |
| C7 | C38 | C3 | C2 | 178.9° | 179.8° |
| C38 | C7 | C6 | H6 | 178.0° | 180.0° |
| C38 | C7 | C8 | H7 | 155.3° | 21.8° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.1° | 0.2° |
| C6 | C5 | C4 | H1 | 179.9° | 180.0° |
| C38 | C3 | C4 | C5 | 0.2° | 0.5° |
| C38 | C3 | C4 | C2 | 179.9° | 179.7° |
| C38 | C3 | C2 | N1 | 4.0° | 179.7° |
| C38 | C3 | C2 | O1 | 176.7° | 0.3° |
| C38 | C3 | C4 | H1 | 179.8° | 179.7° |
| C34 | N3 | C19 | C20 | 97.9° | 40.3° |
| N3 | C34 | N9 | C35 | 150.3° | 174.2° |
| C34 | N3 | C19 | H20 | 22.8° | 160.4° |
| C34 | N3 | C19 | H21 | 141.3° | 79.7° |
| C19 | N3 | C34 | N9 | 17.0° | 15.5° |
| N3 | C19 | C20 | O3 | 45.8° | 74.8° |
| N3 | C19 | C20 | H20 | 120.7° | 120.0° |
| N3 | C19 | C20 | H21 | 120.7° | 120.0° |
| N3 | C19 | C20 | C21 | 161.8° | 165.2° |
| N3 | C19 | H20 | H21 | 117.8° | 119.9° |
| N3 | C19 | C20 | H22 | 75.7° | 45.2° |
| C34 | N9 | C35 | N10 | 1.9° | 5.5° |
| C34 | N9 | C35 | O16 | 179.0° | 174.6° |
| N10 | C35 | N9 | O16 | 179.1° | 179.9° |
| C5 | C4 | C3 | H1 | 180.0° | 179.8° |
| C5 | C4 | C3 | C2 | 179.8° | 179.8° |
| C4 | C5 | C6 | H6 | 179.0° | 180.0° |
| C4 | C3 | C2 | N1 | 175.9° | 0.0° |
| C4 | C3 | C2 | O1 | 3.3° | 179.9° |
| C3 | C4 | C5 | H5 | 179.9° | 179.8° |
| C4 | C3 | C38 | H36 | 178.8° | 179.7° |
| C3 | C2 | N1 | O1 | 179.3° | 179.9° |
| C3 | C2 | N1 | C1 | 161.8° | 180.0° |
| C2 | C3 | C4 | H1 | 0.2° | 0.0° |
| C3 | C2 | N1 | H12 | 18.2° | 0.0° |
| C2 | C3 | C38 | H36 | 1.1° | 0.0° |
| O3 | C20 | C19 | C21 | 116.0° | 120.0° |
| O3 | C20 | C19 | H22 | 121.5° | 120.0° |
| O3 | C20 | C21 | H22 | 122.3° | 120.0° |
| O3 | C20 | C21 | O4 | 153.0° | 180.0° |
| O3 | C20 | C21 | C22 | 86.2° | 60.0° |
| O3 | C20 | C19 | H20 | 166.5° | 165.3° |
| O3 | C20 | C19 | H21 | 75.0° | 45.2° |
| O3 | C20 | C21 | H23 | 34.0° | 60.0° |
| C2 | N1 | C1 | H12 | 180.0° | 180.0° |
| C2 | N1 | C1 | H13 | 180.0° | 60.0° |
| C2 | N1 | C1 | H14 | 60.0° | 180.0° |
| C2 | N1 | C1 | H15 | 60.0° | 60.0° |
| C1 | N1 | C2 | O1 | 17.5° | 0.1° |
| N1 | C1 | H13 | H14 | 120.0° | 119.9° |
| N1 | C1 | H13 | H15 | 120.0° | 120.0° |
| N1 | C1 | H14 | H15 | 120.0° | 120.0° |
| C19 | C20 | C21 | H22 | 122.8° | 120.0° |
| C19 | C20 | C21 | O4 | 38.1° | 60.0° |
| C19 | C20 | C21 | C22 | 158.9° | NaN° |
| C20 | C19 | H20 | H21 | 117.7° | 120.1° |
| C19 | C20 | C21 | H23 | 80.9° | 60.0° |
| C19 | C20 | O3 | H45 | 180.0° | 60.0° |
| N9 | C35 | N10 | H37 | 170.5° | 172.0° |
| O1 | C2 | N1 | H12 | 162.5° | 180.0° |
| O16 | C35 | N10 | H37 | 8.5° | 7.9° |
| C20 | C21 | O4 | C22 | 125.6° | 120.0° |
| C20 | C21 | O4 | H23 | 117.8° | 120.0° |
| C20 | C21 | C22 | H23 | 120.1° | 120.0° |
| C20 | C21 | C22 | O5 | 56.5° | 60.0° |
| C20 | C21 | C22 | C23 | 176.7° | 180.0° |
| C21 | C20 | C19 | H20 | 77.5° | 45.3° |
| C21 | C20 | C19 | H21 | 41.0° | 74.8° |
| C20 | C21 | C22 | H24 | 62.8° | 60.0° |
| C21 | C20 | O3 | H45 | 60.9° | 60.0° |
| C20 | C21 | O4 | H46 | 180.0° | 60.0° |
| O14 | C32 | C33 | C26 | 116.1° | 118.2° |
| O14 | C32 | C33 | H33 | 126.5° | 123.6° |
| O14 | C32 | C26 | H33 | 125.0° | 123.6° |
| O14 | C32 | C33 | O15 | 24.2° | 20.5° |
| O14 | C32 | C33 | C25 | 140.9° | 139.1° |
| O14 | C32 | C26 | N4 | 83.5° | 86.2° |
| O14 | C32 | C26 | O13 | 160.2° | 155.2° |
| O14 | C32 | C26 | H30 | 42.2° | 36.7° |
| O14 | C32 | C33 | H34 | 100.8° | 102.2° |
| O4 | C21 | C22 | H23 | 117.9° | 120.0° |
| O4 | C21 | C22 | O5 | 178.5° | 180.0° |
| O4 | C21 | C22 | C23 | 61.3° | 60.0° |
| O4 | C21 | C20 | H22 | 84.7° | 60.0° |
| O4 | C21 | C22 | H24 | 59.2° | 60.0° |
| C21 | C22 | O5 | C23 | 122.1° | 120.0° |
| C21 | C22 | O5 | H24 | 118.4° | 120.0° |
| C21 | C22 | C23 | H24 | 120.4° | 120.0° |
| C21 | C22 | C23 | O6 | 147.4° | 175.0° |
| C22 | C21 | C20 | H22 | 36.1° | 60.0° |
| C21 | C22 | C23 | H25 | 92.0° | 55.0° |
| C21 | C22 | C23 | H26 | 26.7° | 65.0° |
| C22 | C21 | O4 | H46 | 54.4° | 60.0° |
| C21 | C22 | O5 | H47 | 180.0° | 60.0° |
| C33 | C32 | C26 | H33 | 117.3° | 118.2° |
| C32 | C33 | O15 | C25 | 114.4° | 114.7° |
| C32 | C33 | O15 | H34 | 124.1° | 122.7° |
| C32 | C33 | C25 | H34 | 118.3° | 118.7° |
| C33 | C32 | C26 | N4 | 158.8° | 155.6° |
| C33 | C32 | C26 | O13 | 42.5° | 37.0° |
| C32 | C33 | C25 | O13 | 0.2° | 2.1° |
| C32 | C33 | C25 | C24 | 118.6° | 121.5° |
| C32 | C33 | C25 | H29 | 118.0° | 117.4° |
| C33 | C32 | C26 | H30 | 75.6° | 81.5° |
| C33 | C32 | O14 | H42 | 180.0° | 61.3° |
| C32 | C33 | O15 | H43 | 180.0° | 61.5° |
| C32 | C26 | N4 | C27 | 42.3° | 90.6° |
| C26 | C32 | C33 | O15 | 91.9° | 97.8° |
| C26 | C32 | C33 | C25 | 24.8° | 20.8° |
| C32 | C26 | N4 | O13 | 113.8° | 114.2° |
| C32 | C26 | N4 | H30 | 124.8° | 123.0° |
| C32 | C26 | N4 | C31 | 138.3° | 89.4° |
| C32 | C26 | O13 | H30 | 116.8° | 118.5° |
| C32 | C26 | O13 | C25 | 45.2° | 40.1° |
| C26 | C32 | C33 | H34 | 143.0° | 139.5° |
| C26 | C32 | O14 | H42 | 69.5° | 174.1° |
| O10 | P2 | O11 | O12 | 126.0° | 119.9° |
| O10 | P2 | O11 | O9 | 126.0° | 120.0° |
| O10 | P2 | O12 | O9 | 115.6° | 120.0° |
| O10 | P2 | O12 | C24 | 38.5° | 55.0° |
| O10 | P2 | O9 | P1 | 147.1° | 40.1° |
| O10 | P2 | O11 | H41 | 0.0° | 179.9° |
| O5 | C22 | C23 | H24 | 120.3° | 120.0° |
| O5 | C22 | C23 | O6 | 28.0° | 65.0° |
| O5 | C22 | C21 | H23 | 63.6° | 60.0° |
| O5 | C22 | C23 | H25 | 148.7° | 175.0° |
| O5 | C22 | C23 | H26 | 92.7° | 55.0° |
| N5 | C27 | N4 | H31 | 180.0° | 179.9° |
| N5 | C27 | N4 | C26 | 179.9° | 179.9° |
| N5 | C27 | N4 | C31 | 0.5° | 0.1° |
| C27 | N5 | C28 | C31 | 0.6° | 0.1° |
| C27 | N5 | C28 | C29 | 179.8° | 180.0° |
| N4 | C27 | N5 | C28 | 0.6° | 0.1° |
| C27 | N4 | C26 | C31 | 179.4° | 180.0° |
| C27 | N4 | C26 | O13 | 71.4° | 23.5° |
| C27 | N4 | C31 | C28 | 0.1° | 0.0° |
| C27 | N4 | C31 | N8 | 179.3° | 179.9° |
| C27 | N4 | C26 | H30 | 167.2° | 146.4° |
| O15 | C33 | C25 | H34 | 122.5° | 122.6° |
| O15 | C33 | C25 | O13 | 119.4° | 120.7° |
| O15 | C33 | C25 | C24 | 122.2° | 119.9° |
| O15 | C33 | C25 | H29 | 1.3° | 1.2° |
| O15 | C33 | C32 | H33 | 150.7° | 144.0° |
| C33 | C25 | O13 | C26 | 28.3° | 26.5° |
| C33 | C25 | C24 | O12 | 58.0° | 175.7° |
| C33 | C25 | O13 | C24 | 122.9° | 119.4° |
| C33 | C25 | O13 | H29 | 117.3° | 119.6° |
| C33 | C25 | C24 | H29 | 123.2° | 121.2° |
| C33 | C25 | C24 | H27 | 177.8° | 55.7° |
| C33 | C25 | C24 | H28 | 61.7° | 64.2° |
| C25 | C33 | C32 | H33 | 92.6° | 97.4° |
| C25 | C33 | O15 | H43 | 65.5° | 176.2° |
| N5 | C28 | C31 | N4 | 0.3° | 0.0° |
| N5 | C28 | C31 | C29 | 179.3° | 180.0° |
| N5 | C28 | C29 | N6 | 0.6° | 0.0° |
| N5 | C28 | C31 | N8 | 178.9° | 180.0° |
| N5 | C28 | C29 | N7 | 179.7° | 180.0° |
| C28 | N5 | C27 | H31 | 179.3° | 179.8° |
| C22 | C23 | O6 | H25 | 120.7° | 120.0° |
| C22 | C23 | O6 | H26 | 120.7° | 119.9° |
| C22 | C23 | O6 | P1 | 169.0° | 180.0° |
| C23 | C22 | C21 | H23 | 56.6° | 60.0° |
| C22 | C23 | H25 | H26 | 117.9° | 120.0° |
| C23 | C22 | O5 | H47 | 57.9° | 60.0° |
| O11 | P2 | O12 | O9 | 111.5° | 120.0° |
| O11 | P2 | O12 | C24 | 171.3° | 65.0° |
| O11 | P2 | O9 | P1 | 14.3° | 80.0° |
| N4 | C26 | O13 | H30 | 121.3° | 122.8° |
| C26 | N4 | C31 | C28 | 179.5° | 180.0° |
| C26 | N4 | C31 | N8 | 1.3° | 0.1° |
| N4 | C26 | O13 | C25 | 167.1° | 158.7° |
| C26 | N4 | C27 | H31 | 0.1° | 0.2° |
| N4 | C26 | C32 | H33 | 41.5° | 37.4° |
| C31 | N4 | C26 | O13 | 107.9° | 156.4° |
| N4 | C31 | C28 | N8 | 179.2° | 180.0° |
| N4 | C31 | C28 | C29 | 179.7° | 180.0° |
| N4 | C31 | N8 | C30 | 179.7° | 180.0° |
| C31 | N4 | C26 | H30 | 13.5° | 33.6° |
| C31 | N4 | C27 | H31 | 179.5° | 179.8° |
| P2 | O12 | C24 | C25 | 137.0° | 180.0° |
| O12 | P2 | O9 | P1 | 97.3° | 160.0° |
| P2 | O12 | C24 | H27 | 103.2° | 60.0° |
| P2 | O12 | C24 | H28 | 17.2° | 60.0° |
| O12 | P2 | O11 | H41 | 126.0° | 60.0° |
| O9 | P2 | O12 | C24 | 77.1° | 175.0° |
| P2 | O9 | P1 | O6 | 46.5° | 160.0° |
| P2 | O9 | P1 | O8 | 163.2° | 39.9° |
| P2 | O9 | P1 | O7 | 64.4° | 80.1° |
| O9 | P2 | O11 | H41 | 126.0° | 60.0° |
| C26 | O13 | C25 | C24 | 151.2° | 145.9° |
| C26 | O13 | C25 | H29 | 89.0° | 93.1° |
| O13 | C26 | C32 | H33 | 74.8° | 81.2° |
| C31 | C28 | C29 | N6 | 179.8° | 180.0° |
| C31 | C28 | C29 | N7 | 0.5° | 0.0° |
| C28 | C31 | N8 | C30 | 1.3° | 0.0° |
| C28 | C29 | N6 | N7 | 179.7° | 180.0° |
| C29 | C28 | C31 | N8 | 0.5° | 0.0° |
| C28 | C29 | N7 | C30 | 0.6° | 0.0° |
| C28 | C29 | N6 | H38 | 179.7° | 0.1° |
| C28 | C29 | N6 | H39 | 59.7° | 180.0° |
| C23 | O6 | P1 | O9 | 101.1° | 175.1° |
| C23 | O6 | P1 | O8 | 15.2° | 55.0° |
| C23 | O6 | P1 | O7 | 143.2° | 65.0° |
| O6 | C23 | C22 | H24 | 92.2° | 55.0° |
| O6 | C23 | H25 | H26 | 117.9° | 120.0° |
| N6 | C29 | N7 | C30 | 179.7° | 180.0° |
| C29 | N6 | H38 | H39 | 120.0° | 179.9° |
| C31 | N8 | C30 | N7 | 1.3° | 0.0° |
| C31 | N8 | C30 | H32 | 178.7° | 180.0° |
| C29 | N7 | C30 | N8 | 0.4° | 0.0° |
| C29 | N7 | C30 | H32 | 179.6° | 180.0° |
| N7 | C29 | N6 | H38 | 0.0° | 179.9° |
| N7 | C29 | N6 | H39 | 120.0° | 0.0° |
| O12 | C24 | C25 | O13 | 174.5° | 66.5° |
| O12 | C24 | C25 | H27 | 119.8° | 120.0° |
| O12 | C24 | C25 | H28 | 119.7° | 120.0° |
| O12 | C24 | H27 | H28 | 120.7° | 120.0° |
| O12 | C24 | C25 | H29 | 65.2° | 54.6° |
| O13 | C25 | C24 | H29 | 120.3° | 121.0° |
| O13 | C25 | C24 | H27 | 65.7° | 173.5° |
| O13 | C25 | C24 | H28 | 54.7° | 53.5° |
| C25 | O13 | C26 | H30 | 71.6° | 78.4° |
| O13 | C25 | C33 | H34 | 118.0° | 116.7° |
| C25 | C24 | H27 | H28 | 120.7° | 120.0° |
| C24 | C25 | C33 | H34 | 0.3° | 2.7° |
| O6 | P1 | O9 | O8 | 116.7° | 120.1° |
| O6 | P1 | O9 | O7 | 110.9° | 120.0° |
| O6 | P1 | O8 | O7 | 120.4° | 120.0° |
| P1 | O6 | C23 | H25 | 48.3° | 60.0° |
| P1 | O6 | C23 | H26 | 70.3° | 60.0° |
| O6 | P1 | O7 | H48 | 123.3° | 60.0° |
| O9 | P1 | O8 | O7 | 128.8° | 120.0° |
| O9 | P1 | O7 | H48 | 128.2° | 60.0° |
| N8 | C30 | N7 | H32 | 180.0° | 180.0° |
| O8 | P1 | O7 | H48 | 0.0° | 180.0° |
| H1 | C4 | C5 | H5 | 0.1° | 0.0° |
| H2 | C14 | H3 | H4 | 120.0° | 120.0° |
| H5 | C5 | C6 | H6 | 1.0° | 0.0° |
| H7 | C8 | C9 | H8 | 55.0° | 121.8° |
| H7 | C8 | C9 | H9 | 179.2° | 0.3° |
| H8 | C9 | C10 | H10 | 74.7° | 24.3° |
| H9 | C9 | C10 | H10 | 49.6° | 97.9° |
| H10 | C10 | O2 | H44 | 142.5° | 61.1° |
| H12 | N1 | C1 | H13 | 0.0° | 120.0° |
| H12 | N1 | C1 | H14 | 120.0° | 0.0° |
| H12 | N1 | C1 | H15 | 120.0° | 120.0° |
| H13 | C1 | H14 | H15 | 120.0° | 120.0° |
| H16 | C16 | H17 | H18 | 120.0° | 120.0° |
| H20 | C19 | C20 | H22 | 45.0° | 74.7° |
| H21 | C19 | C20 | H22 | 163.6° | 165.2° |
| H22 | C20 | C21 | H23 | 156.3° | 180.0° |
| H22 | C20 | O3 | H45 | 59.9° | 180.0° |
| H23 | C21 | C22 | H24 | 177.1° | 180.0° |
| H23 | C21 | O4 | H46 | 62.2° | 180.0° |
| H24 | C22 | C23 | H25 | 28.4° | 65.0° |
| H24 | C22 | C23 | H26 | 147.1° | 175.0° |
| H24 | C22 | O5 | H47 | 61.6° | 180.0° |
| H27 | C24 | C25 | H29 | 54.5° | 65.4° |
| H28 | C24 | C25 | H29 | 175.0° | 174.6° |
| H29 | C25 | C33 | H34 | 123.8° | 123.8° |
| H30 | C26 | C32 | H33 | 167.2° | 160.3° |
| H33 | C32 | C33 | H34 | 25.6° | 21.3° |
| H33 | C32 | O14 | H42 | 54.5° | 62.3° |
| H34 | C33 | O15 | H43 | 55.9° | 61.2° |
