A1JJ2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N6 | C30 | sing | 1.32Å | 1.34Å | Aromatic |
| N6 | C29 | doub | 1.33Å | 1.36Å | Aromatic |
| C30 | N7 | doub | 1.32Å | 1.33Å | Aromatic |
| N5 | C29 | sing | 1.38Å | 1.33Å | |
| C29 | C28 | sing | 1.40Å | 1.40Å | Aromatic |
| N7 | C31 | sing | 1.33Å | 1.34Å | Aromatic |
| C28 | C31 | doub | 1.41Å | 1.38Å | Aromatic |
| C28 | N4 | sing | 1.35Å | 1.38Å | Aromatic |
| C31 | N3 | sing | 1.37Å | 1.37Å | Aromatic |
| O14 | C32 | sing | 1.43Å | 1.41Å | |
| O18 | P3 | doub | 1.48Å | 1.53Å | |
| N4 | C27 | doub | 1.30Å | 1.31Å | Aromatic |
| N3 | C26 | sing | 1.47Å | 1.46Å | |
| N3 | C27 | sing | 1.36Å | 1.37Å | Aromatic |
| C26 | C32 | sing | 1.55Å | 1.52Å | |
| C26 | O13 | sing | 1.44Å | 1.43Å | |
| C32 | C33 | sing | 1.55Å | 1.53Å | |
| O15 | P3 | sing | 1.61Å | 1.62Å | |
| O15 | C33 | sing | 1.43Å | 1.43Å | |
| P3 | O17 | sing | 1.61Å | 1.53Å | |
| P3 | O16 | sing | 1.61Å | 1.53Å | |
| C33 | C25 | sing | 1.54Å | 1.54Å | |
| O13 | C25 | sing | 1.44Å | 1.45Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| C24 | O12 | sing | 1.43Å | 1.46Å | |
| O12 | P2 | sing | 1.61Å | 1.60Å | |
| P2 | O9 | sing | 1.61Å | 1.60Å | |
| P2 | O11 | doub | 1.48Å | 1.49Å | |
| P2 | O10 | sing | 1.61Å | 1.49Å | |
| O9 | P1 | sing | 1.61Å | 1.60Å | |
| O8 | P1 | doub | 1.48Å | 1.48Å | |
| P1 | O7 | sing | 1.61Å | 1.49Å | |
| P1 | O6 | sing | 1.61Å | 1.60Å | |
| O6 | C23 | sing | 1.43Å | 1.44Å | |
| O5 | C19 | sing | 1.43Å | 1.43Å | |
| C19 | C18 | sing | 1.51Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.56Å | |
| C23 | C20 | sing | 1.53Å | 1.52Å | |
| N2 | C18 | sing | 1.35Å | 1.34Å | |
| N2 | C17 | sing | 1.47Å | 1.46Å | |
| C18 | O4 | doub | 1.21Å | 1.23Å | |
| C20 | C22 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| O3 | C15 | doub | 1.21Å | 1.24Å | |
| C16 | C15 | sing | 1.51Å | 1.51Å | |
| C15 | N1 | sing | 1.35Å | 1.33Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| N1 | C14 | sing | 1.47Å | 1.47Å | |
| O1 | C5 | sing | 1.43Å | 1.44Å | |
| O1 | C6 | sing | 1.36Å | 1.38Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | S2 | sing | 1.81Å | 1.83Å | |
| C6 | C35 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| S2 | C12 | sing | 1.71Å | 1.79Å | |
| C35 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C34 | sing | 1.39Å | 1.40Å | Aromatic |
| C9 | S1 | sing | 1.76Å | 1.78Å | |
| S1 | C10 | sing | 1.81Å | 1.84Å | |
| C12 | C10 | sing | 1.51Å | 1.52Å | |
| C12 | O2 | doub | 1.21Å | 1.24Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.08Å | 1.08Å | |
| C8 | H11 | sing | 1.08Å | 1.08Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| N1 | H15 | sing | 0.97Å | 1.00Å | |
| N2 | H16 | sing | 0.97Å | 1.00Å | |
| C3 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C2 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| O5 | H29 | sing | 0.97Å | 0.95Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C23 | H36 | sing | 1.09Å | 1.10Å | |
| C23 | H37 | sing | 1.09Å | 1.10Å | |
| O7 | H38 | sing | 0.97Å | 0.95Å | |
| O10 | H39 | sing | 0.97Å | 0.95Å | |
| C24 | H40 | sing | 1.09Å | 1.10Å | |
| C24 | H41 | sing | 1.09Å | 1.10Å | |
| C25 | H42 | sing | 1.09Å | 1.10Å | |
| C26 | H43 | sing | 1.09Å | 1.10Å | |
| C27 | H44 | sing | 1.08Å | 1.08Å | |
| N5 | H45 | sing | 0.97Å | 1.00Å | |
| N5 | H46 | sing | 0.97Å | 1.00Å | |
| C30 | H47 | sing | 1.08Å | 1.08Å | |
| C32 | H48 | sing | 1.09Å | 1.10Å | |
| O14 | H49 | sing | 0.97Å | 0.95Å | |
| C33 | H50 | sing | 1.09Å | 1.10Å | |
| O16 | H51 | sing | 0.97Å | 0.95Å | |
| O17 | H52 | sing | 0.97Å | 0.95Å | |
| C34 | H53 | sing | 1.08Å | 1.08Å | |
| C35 | H54 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | N6 | C29 | 118.8° | 121.2° |
| N6 | C30 | N7 | 129.2° | 122.4° |
| N6 | C30 | H47 | 115.4° | 118.8° |
| N6 | C29 | N5 | 119.2° | 120.8° |
| N6 | C29 | C28 | 117.2° | 118.5° |
| C30 | N7 | C31 | 110.8° | 120.7° |
| N7 | C30 | H47 | 115.4° | 118.8° |
| N5 | C29 | C28 | 123.5° | 120.8° |
| C29 | N5 | H45 | 109.5° | 120.0° |
| C29 | N5 | H46 | 109.5° | 120.0° |
| C29 | C28 | C31 | 117.4° | 118.2° |
| C29 | C28 | N4 | 131.8° | 134.7° |
| N7 | C31 | C28 | 126.7° | 119.0° |
| N7 | C31 | N3 | 127.6° | 134.9° |
| C31 | C28 | N4 | 110.8° | 107.1° |
| C28 | C31 | N3 | 105.7° | 106.0° |
| C28 | N4 | C27 | 103.9° | 109.4° |
| C31 | N3 | C26 | 125.8° | 126.3° |
| C31 | N3 | C27 | 105.8° | 107.4° |
| O14 | C32 | C26 | 105.4° | 110.9° |
| O14 | C32 | C33 | 116.9° | 110.8° |
| O14 | C32 | H48 | 112.3° | 110.8° |
| C32 | O14 | H49 | 109.5° | 114.0° |
| O18 | P3 | O15 | 105.2° | 109.5° |
| O18 | P3 | O17 | 116.0° | 109.5° |
| O18 | P3 | O16 | 105.9° | 109.4° |
| N4 | C27 | N3 | 113.7° | 110.0° |
| N4 | C27 | H44 | 123.1° | 125.1° |
| C26 | N3 | C27 | 128.1° | 126.3° |
| N3 | C26 | C32 | 116.6° | 110.6° |
| N3 | C26 | O13 | 108.2° | 110.6° |
| N3 | C26 | H43 | 109.1° | 110.5° |
| N3 | C27 | H44 | 123.1° | 124.9° |
| C32 | C26 | O13 | 104.9° | 103.5° |
| C26 | C32 | C33 | 100.3° | 102.1° |
| C32 | C26 | H43 | 108.3° | 110.7° |
| C26 | C32 | H48 | 110.6° | 110.9° |
| C26 | O13 | C25 | 109.4° | 107.0° |
| O13 | C26 | H43 | 109.5° | 110.8° |
| C32 | C33 | O15 | 113.3° | 110.5° |
| C32 | C33 | C25 | 103.0° | 104.0° |
| C33 | C32 | H48 | 110.4° | 111.0° |
| C32 | C33 | H50 | 109.7° | 110.5° |
| P3 | O15 | C33 | 122.8° | 123.0° |
| O15 | P3 | O17 | 105.1° | 109.5° |
| O15 | P3 | O16 | 111.8° | 109.5° |
| O15 | C33 | C25 | 109.5° | 110.6° |
| O15 | C33 | H50 | 111.3° | 110.6° |
| O17 | P3 | O16 | 112.8° | 109.5° |
| P3 | O17 | H52 | 109.5° | 114.0° |
| P3 | O16 | H51 | 109.5° | 114.1° |
| C33 | C25 | O13 | 105.6° | 107.4° |
| C33 | C25 | C24 | 116.5° | 109.9° |
| C33 | C25 | H42 | 108.0° | 109.9° |
| C25 | C33 | H50 | 109.7° | 110.5° |
| O13 | C25 | C24 | 108.9° | 109.9° |
| O13 | C25 | H42 | 109.2° | 109.8° |
| C25 | C24 | O12 | 109.9° | 109.5° |
| C25 | C24 | H40 | 109.4° | 109.5° |
| C25 | C24 | H41 | 109.4° | 109.5° |
| C24 | C25 | H42 | 108.4° | 109.9° |
| C24 | O12 | P2 | 118.2° | 123.0° |
| O12 | C24 | H40 | 109.3° | 109.5° |
| O12 | C24 | H41 | 109.4° | 109.4° |
| O12 | P2 | O9 | 95.5° | 109.5° |
| O12 | P2 | O11 | 108.7° | 109.5° |
| O12 | P2 | O10 | 109.7° | 109.4° |
| O9 | P2 | O11 | 109.5° | 109.5° |
| O9 | P2 | O10 | 118.4° | 109.5° |
| P2 | O9 | P1 | 128.9° | 134.0° |
| O11 | P2 | O10 | 113.4° | 109.5° |
| P2 | O10 | H39 | 109.5° | 114.0° |
| O9 | P1 | O8 | 109.9° | 109.5° |
| O9 | P1 | O7 | 104.0° | 109.5° |
| O9 | P1 | O6 | 97.0° | 109.5° |
| O8 | P1 | O7 | 127.4° | 109.5° |
| O8 | P1 | O6 | 98.2° | 109.5° |
| O7 | P1 | O6 | 116.4° | 109.5° |
| P1 | O7 | H38 | 109.5° | 114.0° |
| P1 | O6 | C23 | 123.2° | 123.0° |
| O6 | C23 | C20 | 109.7° | 109.5° |
| O6 | C23 | H36 | 109.4° | 109.5° |
| O6 | C23 | H37 | 109.4° | 109.5° |
| O5 | C19 | C18 | 111.0° | 109.5° |
| O5 | C19 | C20 | 110.1° | 109.5° |
| O5 | C19 | H28 | 109.0° | 109.5° |
| C19 | O5 | H29 | 109.5° | 114.0° |
| C18 | C19 | C20 | 111.5° | 109.5° |
| C19 | C18 | N2 | 116.6° | 120.0° |
| C19 | C18 | O4 | 119.7° | 120.0° |
| C18 | C19 | H28 | 107.8° | 109.5° |
| C19 | C20 | C23 | 111.5° | 109.5° |
| C19 | C20 | C22 | 109.6° | 109.5° |
| C19 | C20 | C21 | 113.5° | 109.5° |
| C20 | C19 | H28 | 107.3° | 109.4° |
| C23 | C20 | C22 | 111.3° | 109.5° |
| C23 | C20 | C21 | 102.2° | 109.5° |
| C20 | C23 | H36 | 109.4° | 109.4° |
| C20 | C23 | H37 | 109.4° | 109.5° |
| C18 | N2 | C17 | 122.0° | 120.0° |
| N2 | C18 | O4 | 123.8° | 120.0° |
| C18 | N2 | H16 | 119.0° | 120.0° |
| N2 | C17 | C16 | 113.1° | 109.4° |
| C17 | N2 | H16 | 119.0° | 120.0° |
| N2 | C17 | H26 | 108.6° | 109.4° |
| N2 | C17 | H27 | 108.5° | 109.5° |
| C22 | C20 | C21 | 108.6° | 109.5° |
| C20 | C22 | H33 | 109.5° | 109.5° |
| C20 | C22 | H34 | 109.5° | 109.5° |
| C20 | C22 | H35 | 109.5° | 109.4° |
| C20 | C21 | H30 | 109.5° | 109.5° |
| C20 | C21 | H31 | 109.4° | 109.5° |
| C20 | C21 | H32 | 109.5° | 109.5° |
| C17 | C16 | C15 | 112.5° | 109.5° |
| C17 | C16 | H24 | 108.7° | 109.5° |
| C17 | C16 | H25 | 108.7° | 109.5° |
| C16 | C17 | H26 | 108.5° | 109.5° |
| C16 | C17 | H27 | 108.6° | 109.5° |
| O3 | C15 | C16 | 122.0° | 120.0° |
| O3 | C15 | N1 | 121.6° | 120.0° |
| C16 | C15 | N1 | 116.4° | 120.0° |
| C15 | C16 | H24 | 108.7° | 109.4° |
| C15 | C16 | H25 | 108.7° | 109.4° |
| C15 | N1 | C14 | 121.3° | 120.0° |
| C15 | N1 | H15 | 119.3° | 120.0° |
| C3 | C4 | C5 | 113.8° | 109.5° |
| C4 | C3 | C2 | 116.0° | 109.5° |
| C3 | C4 | H1 | 108.4° | 109.5° |
| C3 | C4 | H2 | 108.4° | 109.5° |
| C4 | C3 | H17 | 107.8° | 109.4° |
| C4 | C3 | H18 | 107.8° | 109.4° |
| C4 | C5 | O1 | 108.4° | 109.5° |
| C5 | C4 | H1 | 108.4° | 109.4° |
| C5 | C4 | H2 | 108.4° | 109.5° |
| C4 | C5 | H5 | 109.7° | 109.5° |
| C4 | C5 | H6 | 109.7° | 109.4° |
| C3 | C2 | C1 | 115.1° | 109.5° |
| C2 | C3 | H17 | 107.8° | 109.5° |
| C2 | C3 | H18 | 107.8° | 109.5° |
| C3 | C2 | H22 | 108.0° | 109.5° |
| C3 | C2 | H23 | 108.1° | 109.5° |
| C2 | C1 | H19 | 109.5° | 109.4° |
| C2 | C1 | H20 | 109.5° | 109.5° |
| C2 | C1 | H21 | 109.5° | 109.5° |
| C1 | C2 | H22 | 108.1° | 109.4° |
| C1 | C2 | H23 | 108.0° | 109.5° |
| N1 | C14 | C13 | 113.7° | 109.4° |
| N1 | C14 | H3 | 108.4° | 109.4° |
| N1 | C14 | H4 | 108.4° | 109.4° |
| C14 | N1 | H15 | 119.4° | 120.0° |
| C5 | O1 | C6 | 119.9° | 117.1° |
| O1 | C5 | H5 | 109.7° | 109.5° |
| O1 | C5 | H6 | 109.7° | 109.5° |
| O1 | C6 | C7 | 116.9° | 119.9° |
| O1 | C6 | C35 | 123.7° | 120.0° |
| C14 | C13 | S2 | 115.1° | 109.4° |
| C13 | C14 | H3 | 108.4° | 109.5° |
| C13 | C14 | H4 | 108.4° | 109.5° |
| C14 | C13 | H13 | 108.0° | 109.5° |
| C14 | C13 | H14 | 108.0° | 109.5° |
| C6 | C7 | C8 | 120.5° | 120.0° |
| C7 | C6 | C35 | 119.4° | 120.1° |
| C6 | C7 | H10 | 119.8° | 120.0° |
| C7 | C8 | C9 | 120.8° | 120.0° |
| C8 | C7 | H10 | 119.8° | 120.0° |
| C7 | C8 | H11 | 119.6° | 120.0° |
| C13 | S2 | C12 | 104.6° | 100.0° |
| S2 | C13 | H13 | 108.1° | 109.4° |
| S2 | C13 | H14 | 108.1° | 109.5° |
| C6 | C35 | C34 | 120.1° | 120.1° |
| C6 | C35 | H54 | 119.9° | 120.0° |
| C8 | C9 | C34 | 118.4° | 119.9° |
| C8 | C9 | S1 | 120.3° | 120.0° |
| C9 | C8 | H11 | 119.6° | 120.0° |
| S2 | C12 | C10 | 115.0° | 120.0° |
| S2 | C12 | O2 | 123.8° | 120.0° |
| C35 | C34 | C9 | 120.9° | 120.0° |
| C35 | C34 | H53 | 119.6° | 120.0° |
| C34 | C35 | H54 | 120.0° | 119.9° |
| C34 | C9 | S1 | 121.3° | 120.1° |
| C9 | C34 | H53 | 119.6° | 120.0° |
| C9 | S1 | C10 | 108.6° | 103.0° |
| S1 | C10 | C12 | 111.9° | 109.4° |
| S1 | C10 | C11 | 114.4° | 109.5° |
| S1 | C10 | H12 | 104.8° | 109.5° |
| C10 | C12 | O2 | 121.1° | 120.0° |
| C12 | C10 | C11 | 109.4° | 109.5° |
| C12 | C10 | H12 | 108.0° | 109.5° |
| C10 | C11 | H7 | 109.5° | 109.5° |
| C10 | C11 | H8 | 109.5° | 109.5° |
| C10 | C11 | H9 | 109.5° | 109.5° |
| C11 | C10 | H12 | 108.1° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.4° |
| H3 | C14 | H4 | 109.5° | 109.5° |
| H5 | C5 | H6 | 109.5° | 109.4° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H7 | C11 | H9 | 109.5° | 109.4° |
| H8 | C11 | H9 | 109.5° | 109.5° |
| H13 | C13 | H14 | 109.5° | 109.5° |
| H17 | C3 | H18 | 109.5° | 109.5° |
| H19 | C1 | H20 | 109.5° | 109.4° |
| H19 | C1 | H21 | 109.4° | 109.5° |
| H20 | C1 | H21 | 109.5° | 109.5° |
| H22 | C2 | H23 | 109.5° | 109.4° |
| H24 | C16 | H25 | 109.5° | 109.5° |
| H26 | C17 | H27 | 109.5° | 109.5° |
| H30 | C21 | H31 | 109.4° | 109.5° |
| H30 | C21 | H32 | 109.5° | 109.5° |
| H31 | C21 | H32 | 109.5° | 109.4° |
| H33 | C22 | H34 | 109.5° | 109.5° |
| H33 | C22 | H35 | 109.5° | 109.5° |
| H34 | C22 | H35 | 109.5° | 109.5° |
| H36 | C23 | H37 | 109.5° | 109.5° |
| H40 | C24 | H41 | 109.5° | 109.4° |
| H45 | N5 | H46 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N6 | C30 | N7 | H47 | 180.0° | 179.9° |
| C30 | N6 | C29 | N5 | 178.8° | 180.0° |
| C30 | N6 | C29 | C28 | 2.1° | 0.1° |
| N6 | C30 | N7 | C31 | 0.0° | 0.1° |
| C29 | N6 | C30 | N7 | 1.3° | 0.1° |
| N6 | C29 | N5 | C28 | 176.5° | 179.9° |
| N6 | C29 | C28 | C31 | 1.8° | 0.0° |
| N6 | C29 | C28 | N4 | 178.5° | 179.5° |
| N6 | C29 | N5 | H45 | 0.0° | 180.0° |
| N6 | C29 | N5 | H46 | 120.0° | 0.0° |
| C29 | N6 | C30 | H47 | 178.7° | 180.0° |
| C30 | N7 | C31 | C28 | 0.4° | 0.0° |
| C30 | N7 | C31 | N3 | 179.6° | 179.9° |
| N5 | C29 | C28 | C31 | 178.3° | 180.0° |
| N5 | C29 | C28 | N4 | 1.9° | 0.5° |
| C29 | N5 | H45 | H46 | 120.0° | 179.9° |
| C29 | C28 | C31 | N7 | 0.5° | 0.0° |
| C29 | C28 | C31 | N4 | 179.8° | 179.6° |
| C29 | C28 | C31 | N3 | 179.5° | 180.0° |
| C29 | C28 | N4 | C27 | 179.8° | 179.7° |
| C28 | C29 | N5 | H45 | 176.5° | 0.1° |
| C28 | C29 | N5 | H46 | 56.5° | 180.0° |
| N7 | C31 | C28 | N3 | 180.0° | 179.9° |
| N7 | C31 | C28 | N4 | 179.7° | 179.6° |
| N7 | C31 | N3 | C26 | 5.3° | 0.2° |
| N7 | C31 | N3 | C27 | 179.1° | 179.5° |
| C31 | N7 | C30 | H47 | 180.0° | 180.0° |
| C31 | C28 | N4 | C27 | 0.4° | 0.2° |
| C28 | C31 | N3 | C26 | 174.7° | 179.9° |
| C28 | C31 | N3 | C27 | 0.9° | 0.4° |
| N4 | C28 | C31 | N3 | 0.3° | 0.3° |
| C28 | N4 | C27 | N3 | 1.0° | 0.0° |
| C28 | N4 | C27 | H44 | 179.0° | 180.0° |
| C31 | N3 | C27 | N4 | 1.3° | 0.3° |
| C31 | N3 | C26 | C27 | 172.4° | 179.7° |
| C31 | N3 | C26 | C32 | 110.2° | 84.8° |
| C31 | N3 | C26 | O13 | 131.9° | 161.2° |
| C31 | N3 | C26 | H43 | 12.9° | 38.1° |
| C31 | N3 | C27 | H44 | 178.7° | 179.8° |
| O14 | C32 | C26 | N3 | 78.3° | 86.3° |
| O14 | C32 | C26 | C33 | 121.8° | 118.1° |
| O14 | C32 | C26 | H48 | 121.7° | 123.6° |
| O14 | C32 | C26 | O13 | 162.0° | 155.2° |
| O14 | C32 | C33 | H48 | 130.0° | 123.6° |
| O14 | C32 | C33 | O15 | 31.6° | 20.4° |
| O14 | C32 | C33 | C25 | 149.9° | 139.1° |
| O14 | C32 | C26 | H43 | 45.1° | 36.5° |
| O14 | C32 | C33 | H50 | 93.4° | 102.3° |
| O18 | P3 | O15 | O17 | 122.9° | 120.0° |
| O18 | P3 | O15 | O16 | 114.5° | 120.0° |
| O18 | P3 | O15 | C33 | 98.6° | 55.0° |
| O18 | P3 | O17 | O16 | 122.4° | 119.9° |
| O18 | P3 | O16 | H51 | 0.0° | 60.0° |
| O18 | P3 | O17 | H52 | 0.0° | 179.9° |
| N4 | C27 | N3 | C26 | 174.9° | 180.0° |
| N4 | C27 | N3 | H44 | 180.0° | 179.9° |
| N3 | C26 | C32 | O13 | 119.7° | 118.5° |
| N3 | C26 | C32 | H43 | 123.5° | 122.8° |
| N3 | C26 | O13 | H43 | 118.8° | 122.9° |
| N3 | C26 | C32 | C33 | 159.9° | 155.6° |
| N3 | C26 | O13 | C25 | 153.7° | 158.5° |
| C26 | N3 | C27 | H44 | 5.1° | 0.0° |
| N3 | C26 | C32 | H48 | 43.4° | 37.3° |
| C27 | N3 | C26 | C32 | 77.4° | 95.0° |
| C27 | N3 | C26 | O13 | 40.5° | 19.1° |
| C27 | N3 | C26 | H43 | 159.5° | 142.2° |
| C32 | C26 | O13 | H43 | 116.1° | 118.7° |
| C26 | C32 | C33 | H48 | 116.7° | 118.3° |
| C26 | C32 | C33 | O15 | 81.6° | 97.7° |
| C26 | C32 | C33 | C25 | 36.6° | 21.0° |
| C32 | C26 | O13 | C25 | 28.5° | 40.1° |
| C26 | C32 | O14 | H49 | 180.0° | 61.5° |
| C26 | C32 | C33 | H50 | 153.3° | 139.6° |
| O13 | C26 | C32 | C33 | 40.2° | 37.1° |
| C26 | O13 | C25 | C33 | 4.3° | 26.4° |
| C26 | O13 | C25 | C24 | 130.2° | 145.9° |
| C26 | O13 | C25 | H42 | 111.7° | 93.1° |
| O13 | C26 | C32 | H48 | 76.3° | 81.2° |
| C32 | C33 | O15 | P3 | 120.8° | 121.4° |
| C32 | C33 | O15 | C25 | 114.4° | 114.6° |
| C32 | C33 | O15 | H50 | 124.2° | 122.7° |
| C32 | C33 | C25 | H50 | 116.8° | 118.6° |
| C32 | C33 | C25 | O13 | 21.1° | 1.9° |
| C32 | C33 | C25 | C24 | 100.0° | 121.4° |
| C32 | C33 | C25 | H42 | 137.8° | 117.5° |
| C33 | C32 | C26 | H43 | 76.6° | 81.6° |
| C33 | C32 | O14 | H49 | 69.7° | 174.1° |
| O15 | P3 | O17 | O16 | 122.0° | 120.1° |
| P3 | O15 | C33 | C25 | 124.8° | 123.9° |
| P3 | O15 | C33 | H50 | 3.4° | 1.2° |
| O15 | P3 | O16 | H51 | 114.0° | 180.0° |
| O15 | P3 | O17 | H52 | 115.6° | 60.1° |
| C33 | O15 | P3 | O17 | 138.5° | 65.0° |
| C33 | O15 | P3 | O16 | 15.8° | 175.0° |
| O15 | C33 | C25 | H50 | 122.3° | 122.8° |
| O15 | C33 | C25 | O13 | 99.7° | 120.6° |
| O15 | C33 | C25 | C24 | 139.2° | 119.9° |
| O15 | C33 | C25 | H42 | 17.0° | 1.1° |
| O15 | C33 | C32 | H48 | 161.7° | 144.0° |
| O17 | P3 | O16 | H51 | 127.9° | 60.0° |
| O16 | P3 | O17 | H52 | 122.4° | 60.0° |
| C33 | C25 | O13 | C24 | 125.9° | 119.5° |
| C33 | C25 | O13 | H42 | 115.9° | 119.5° |
| C33 | C25 | C24 | H42 | 122.0° | 121.0° |
| C33 | C25 | C24 | O12 | 47.7° | 175.3° |
| C33 | C25 | C24 | H40 | 72.3° | 64.7° |
| C33 | C25 | C24 | H41 | 167.8° | 55.3° |
| C25 | C33 | C32 | H48 | 80.1° | 97.3° |
| O13 | C25 | C24 | H42 | 118.7° | 121.0° |
| O13 | C25 | C24 | O12 | 167.0° | 66.7° |
| O13 | C25 | C24 | H40 | 47.0° | 53.3° |
| O13 | C25 | C24 | H41 | 72.9° | 173.3° |
| C25 | O13 | C26 | H43 | 87.6° | 78.6° |
| O13 | C25 | C33 | H50 | 137.9° | 116.7° |
| C25 | C24 | O12 | H40 | 120.1° | 120.0° |
| C25 | C24 | O12 | H41 | 120.1° | 120.1° |
| C25 | C24 | O12 | P2 | 149.0° | 180.0° |
| C25 | C24 | H40 | H41 | 119.8° | 120.1° |
| C24 | C25 | C33 | H50 | 16.8° | 2.8° |
| C24 | O12 | P2 | O9 | 44.8° | 175.0° |
| C24 | O12 | P2 | O11 | 67.9° | 55.0° |
| C24 | O12 | P2 | O10 | 167.6° | 65.0° |
| O12 | C24 | H40 | H41 | 119.8° | 119.9° |
| O12 | C24 | C25 | H42 | 74.3° | 54.3° |
| O12 | P2 | O9 | O11 | 112.0° | 120.0° |
| O12 | P2 | O9 | O10 | 115.9° | 120.0° |
| O12 | P2 | O11 | O10 | 122.3° | 120.0° |
| O12 | P2 | O9 | P1 | 139.6° | 160.0° |
| O12 | P2 | O10 | H39 | 121.7° | 60.0° |
| P2 | O12 | C24 | H40 | 90.9° | 60.0° |
| P2 | O12 | C24 | H41 | 28.9° | 59.9° |
| O9 | P2 | O11 | O10 | 134.6° | 120.0° |
| P2 | O9 | P1 | O8 | 169.8° | 40.0° |
| P2 | O9 | P1 | O7 | 30.7° | 80.0° |
| P2 | O9 | P1 | O6 | 88.8° | 160.0° |
| O9 | P2 | O10 | H39 | 130.3° | 60.0° |
| O11 | P2 | O9 | P1 | 108.4° | 40.0° |
| O11 | P2 | O10 | H39 | 0.0° | 180.0° |
| O10 | P2 | O9 | P1 | 23.7° | 80.0° |
| O9 | P1 | O8 | O7 | 127.0° | 120.0° |
| O9 | P1 | O8 | O6 | 100.5° | 120.0° |
| O9 | P1 | O7 | O6 | 105.3° | 120.0° |
| O9 | P1 | O6 | C23 | 132.5° | 175.0° |
| O9 | P1 | O7 | H38 | 129.3° | 60.0° |
| O8 | P1 | O7 | O6 | 125.4° | 120.0° |
| O8 | P1 | O6 | C23 | 116.1° | 55.0° |
| O8 | P1 | O7 | H38 | 0.0° | 180.0° |
| O7 | P1 | O6 | C23 | 23.0° | 65.0° |
| P1 | O6 | C23 | C20 | 150.6° | 180.0° |
| P1 | O6 | C23 | H36 | 89.4° | 60.0° |
| P1 | O6 | C23 | H37 | 30.6° | 60.0° |
| O6 | P1 | O7 | H38 | 125.4° | 60.1° |
| O6 | C23 | C20 | C19 | 53.8° | 180.0° |
| O6 | C23 | C20 | H36 | 120.0° | 120.0° |
| O6 | C23 | C20 | H37 | 120.1° | 120.0° |
| O6 | C23 | C20 | C22 | 68.9° | 60.0° |
| O6 | C23 | C20 | C21 | 175.4° | 60.0° |
| O6 | C23 | H36 | H37 | 119.9° | 120.0° |
| O5 | C19 | C18 | C20 | 123.2° | 120.0° |
| O5 | C19 | C18 | H28 | 119.3° | 120.0° |
| O5 | C19 | C20 | H28 | 118.5° | 120.0° |
| O5 | C19 | C20 | C23 | 91.9° | 58.9° |
| O5 | C19 | C18 | N2 | 1.5° | 7.3° |
| O5 | C19 | C18 | O4 | 179.4° | 172.7° |
| O5 | C19 | C20 | C22 | 31.7° | 61.2° |
| O5 | C19 | C20 | C21 | 153.4° | 178.9° |
| C18 | C19 | C20 | H28 | 117.8° | 120.0° |
| C18 | C19 | C20 | C23 | 144.3° | 178.9° |
| C19 | C18 | N2 | O4 | 179.1° | 179.9° |
| C19 | C18 | N2 | C17 | 178.9° | 175.3° |
| C18 | C19 | C20 | C22 | 92.0° | 58.9° |
| C18 | C19 | C20 | C21 | 29.6° | 61.1° |
| C19 | C18 | N2 | H16 | 1.1° | 4.8° |
| C18 | C19 | O5 | H29 | 110.0° | 60.0° |
| C19 | C20 | C23 | C22 | 122.7° | 120.0° |
| C19 | C20 | C23 | C21 | 121.5° | 120.0° |
| C20 | C19 | C18 | N2 | 121.7° | 112.7° |
| C20 | C19 | C18 | O4 | 57.4° | 67.2° |
| C19 | C20 | C22 | C21 | 124.5° | 120.0° |
| C20 | C19 | O5 | H29 | 126.0° | 60.0° |
| C19 | C20 | C21 | H30 | 180.0° | 68.1° |
| C19 | C20 | C21 | H31 | 60.0° | 171.9° |
| C19 | C20 | C21 | H32 | 60.0° | 52.0° |
| C19 | C20 | C22 | H33 | 180.0° | 60.0° |
| C19 | C20 | C22 | H34 | 60.0° | 180.0° |
| C19 | C20 | C22 | H35 | 60.0° | 60.0° |
| C19 | C20 | C23 | H36 | 173.9° | 60.0° |
| C19 | C20 | C23 | H37 | 66.2° | 60.0° |
| C23 | C20 | C22 | C21 | 111.7° | 120.0° |
| C23 | C20 | C19 | H28 | 26.5° | 61.1° |
| C23 | C20 | C21 | H30 | 59.8° | 171.9° |
| C23 | C20 | C21 | H31 | 60.1° | 51.9° |
| C23 | C20 | C21 | H32 | 179.9° | 68.0° |
| C23 | C20 | C22 | H33 | 56.2° | 60.0° |
| C23 | C20 | C22 | H34 | 176.2° | 60.0° |
| C23 | C20 | C22 | H35 | 63.8° | 180.0° |
| C20 | C23 | H36 | H37 | 119.9° | 120.0° |
| C18 | N2 | C17 | H16 | 180.0° | 180.0° |
| C18 | N2 | C17 | C16 | 71.3° | 180.0° |
| C18 | N2 | C17 | H26 | 49.2° | 60.1° |
| C18 | N2 | C17 | H27 | 168.1° | 60.0° |
| N2 | C18 | C19 | H28 | 120.8° | 127.3° |
| C17 | N2 | C18 | O4 | 0.2° | 4.7° |
| N2 | C17 | C16 | H26 | 120.6° | 119.9° |
| N2 | C17 | C16 | H27 | 120.5° | 120.0° |
| N2 | C17 | C16 | C15 | 35.8° | 180.0° |
| N2 | C17 | C16 | H24 | 84.6° | 60.0° |
| N2 | C17 | C16 | H25 | 156.2° | 60.1° |
| N2 | C17 | H26 | H27 | 118.3° | 120.0° |
| O4 | C18 | N2 | H16 | 179.9° | 175.3° |
| O4 | C18 | C19 | H28 | 60.1° | 52.7° |
| C22 | C20 | C19 | H28 | 150.2° | 178.9° |
| C22 | C20 | C21 | H30 | 57.8° | 51.9° |
| C22 | C20 | C21 | H31 | 177.8° | 68.1° |
| C22 | C20 | C21 | H32 | 62.2° | 172.0° |
| C20 | C22 | H33 | H34 | 120.0° | 120.0° |
| C20 | C22 | H33 | H35 | 120.0° | 120.0° |
| C20 | C22 | H34 | H35 | 120.0° | 120.0° |
| C22 | C20 | C23 | H36 | 51.1° | 60.0° |
| C22 | C20 | C23 | H37 | 171.0° | 180.0° |
| C21 | C20 | C19 | H28 | 88.2° | 58.9° |
| C20 | C21 | H30 | H31 | 120.0° | 120.0° |
| C20 | C21 | H30 | H32 | 120.0° | 120.1° |
| C20 | C21 | H31 | H32 | 120.0° | 120.0° |
| C21 | C20 | C22 | H33 | 55.5° | 180.0° |
| C21 | C20 | C22 | H34 | 64.5° | 60.0° |
| C21 | C20 | C22 | H35 | 175.5° | 60.0° |
| C21 | C20 | C23 | H36 | 64.6° | 180.0° |
| C21 | C20 | C23 | H37 | 55.3° | 60.0° |
| C17 | C16 | C15 | O3 | 37.0° | 0.0° |
| C17 | C16 | C15 | H24 | 120.5° | 120.0° |
| C17 | C16 | C15 | H25 | 120.5° | 120.0° |
| C17 | C16 | C15 | N1 | 145.0° | 180.0° |
| C16 | C17 | N2 | H16 | 108.6° | 0.0° |
| C17 | C16 | H24 | H25 | 118.6° | 120.1° |
| C16 | C17 | H26 | H27 | 118.4° | 120.1° |
| O3 | C15 | C16 | N1 | 178.0° | 179.9° |
| O3 | C15 | N1 | C14 | 2.3° | 0.1° |
| O3 | C15 | N1 | H15 | 177.6° | 180.0° |
| O3 | C15 | C16 | H24 | 157.5° | 120.0° |
| O3 | C15 | C16 | H25 | 83.4° | 120.0° |
| C16 | C15 | N1 | C14 | 175.6° | 180.0° |
| C16 | C15 | N1 | H15 | 4.4° | 0.0° |
| C15 | C16 | H24 | H25 | 118.6° | 119.9° |
| C15 | C16 | C17 | H26 | 156.3° | 60.1° |
| C15 | C16 | C17 | H27 | 84.7° | 60.0° |
| C15 | N1 | C14 | H15 | 180.0° | 179.9° |
| C15 | N1 | C14 | C13 | 63.8° | 180.0° |
| C15 | N1 | C14 | H3 | 56.9° | 60.1° |
| C15 | N1 | C14 | H4 | 175.6° | 59.9° |
| N1 | C15 | C16 | H24 | 24.6° | 60.0° |
| N1 | C15 | C16 | H25 | 94.5° | 59.9° |
| C3 | C4 | C5 | H1 | 120.6° | 120.0° |
| C3 | C4 | C5 | H2 | 120.6° | 120.1° |
| C4 | C3 | C2 | H17 | 120.9° | 120.0° |
| C4 | C3 | C2 | H18 | 121.0° | 120.0° |
| C4 | C3 | C2 | C1 | 72.3° | 180.0° |
| C3 | C4 | C5 | O1 | 31.2° | 180.0° |
| C3 | C4 | H1 | H2 | 118.0° | 120.0° |
| C3 | C4 | C5 | H5 | 151.0° | 60.0° |
| C3 | C4 | C5 | H6 | 88.6° | 60.0° |
| C4 | C3 | H17 | H18 | 117.1° | 119.9° |
| C4 | C3 | C2 | H22 | 48.5° | 60.0° |
| C4 | C3 | C2 | H23 | 166.9° | 60.0° |
| C5 | C4 | C3 | C2 | 161.6° | 180.0° |
| C4 | C5 | O1 | H5 | 119.8° | 120.1° |
| C4 | C5 | O1 | H6 | 119.8° | 120.0° |
| C4 | C5 | O1 | C6 | 171.0° | 180.0° |
| C5 | C4 | H1 | H2 | 118.0° | 119.9° |
| C4 | C5 | H5 | H6 | 120.5° | 119.9° |
| C5 | C4 | C3 | H17 | 77.4° | 60.0° |
| C5 | C4 | C3 | H18 | 40.7° | 59.9° |
| C3 | C2 | C1 | H22 | 120.8° | 120.0° |
| C3 | C2 | C1 | H23 | 120.8° | 120.0° |
| C2 | C3 | C4 | H1 | 77.7° | 60.0° |
| C2 | C3 | C4 | H2 | 41.0° | 60.0° |
| C2 | C3 | H17 | H18 | 117.0° | 120.1° |
| C3 | C2 | C1 | H19 | 180.0° | 60.0° |
| C3 | C2 | C1 | H20 | 60.0° | 60.0° |
| C3 | C2 | C1 | H21 | 60.0° | 180.0° |
| C3 | C2 | H22 | H23 | 117.5° | 120.0° |
| C1 | C2 | C3 | H17 | 166.8° | 60.0° |
| C1 | C2 | C3 | H18 | 48.7° | 60.0° |
| C2 | C1 | H19 | H20 | 120.0° | 120.0° |
| C2 | C1 | H19 | H21 | 120.0° | 120.0° |
| C2 | C1 | H20 | H21 | 120.0° | 120.1° |
| C1 | C2 | H22 | H23 | 117.4° | 119.9° |
| N1 | C14 | C13 | H3 | 120.6° | 119.9° |
| N1 | C14 | C13 | H4 | 120.6° | 120.0° |
| N1 | C14 | C13 | S2 | 178.0° | 179.9° |
| N1 | C14 | H3 | H4 | 118.1° | 120.0° |
| N1 | C14 | C13 | H13 | 61.2° | 60.0° |
| N1 | C14 | C13 | H14 | 57.1° | 60.0° |
| C5 | O1 | C6 | C7 | 177.5° | 0.2° |
| C5 | O1 | C6 | C35 | 2.7° | 180.0° |
| O1 | C5 | C4 | H1 | 89.4° | 60.0° |
| O1 | C5 | C4 | H2 | 151.9° | 59.9° |
| O1 | C5 | H5 | H6 | 120.5° | 120.0° |
| O1 | C6 | C7 | C35 | 179.8° | 179.8° |
| O1 | C6 | C7 | C8 | 180.0° | 179.7° |
| O1 | C6 | C35 | C34 | 179.8° | 179.7° |
| C6 | O1 | C5 | H5 | 69.2° | 59.9° |
| C6 | O1 | C5 | H6 | 51.2° | 60.0° |
| O1 | C6 | C7 | H10 | 0.0° | 0.3° |
| O1 | C6 | C35 | H54 | 0.2° | 0.2° |
| C14 | C13 | S2 | H13 | 120.8° | 119.9° |
| C14 | C13 | S2 | H14 | 120.8° | 120.0° |
| C14 | C13 | S2 | C12 | 82.2° | 180.0° |
| C13 | C14 | H3 | H4 | 118.1° | 120.1° |
| C14 | C13 | H13 | H14 | 117.4° | 120.1° |
| C13 | C14 | N1 | H15 | 116.3° | 0.0° |
| C6 | C7 | C8 | H10 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.2° | 0.0° |
| C7 | C6 | C35 | C34 | 0.0° | 0.0° |
| C6 | C7 | C8 | H11 | 179.8° | 180.0° |
| C7 | C6 | C35 | H54 | 180.0° | 180.0° |
| C8 | C7 | C6 | C35 | 0.2° | 0.0° |
| C7 | C8 | C9 | H11 | 180.0° | 180.0° |
| C7 | C8 | C9 | C34 | 0.0° | 0.0° |
| C7 | C8 | C9 | S1 | 179.5° | 180.0° |
| C13 | S2 | C12 | C10 | 165.5° | 180.0° |
| C13 | S2 | C12 | O2 | 10.8° | 0.0° |
| S2 | C13 | C14 | H3 | 57.3° | 60.0° |
| S2 | C13 | C14 | H4 | 61.4° | 60.1° |
| S2 | C13 | H13 | H14 | 117.4° | 120.0° |
| C6 | C35 | C34 | H54 | 180.0° | 179.9° |
| C6 | C35 | C34 | C9 | 0.2° | 0.0° |
| C35 | C6 | C7 | H10 | 179.7° | 179.9° |
| C6 | C35 | C34 | H53 | 179.8° | 179.9° |
| C8 | C9 | C34 | C35 | 0.3° | 0.0° |
| C8 | C9 | C34 | S1 | 179.5° | 180.0° |
| C8 | C9 | S1 | C10 | 51.7° | 173.1° |
| C9 | C8 | C7 | H10 | 179.8° | 180.0° |
| C8 | C9 | C34 | H53 | 179.7° | 180.0° |
| S2 | C12 | C10 | S1 | 39.7° | 155.0° |
| S2 | C12 | C10 | O2 | 176.4° | 180.0° |
| S2 | C12 | C10 | C11 | 167.5° | 85.0° |
| S2 | C12 | C10 | H12 | 75.1° | 35.0° |
| C12 | S2 | C13 | H13 | 38.6° | 60.0° |
| C12 | S2 | C13 | H14 | 156.9° | 60.0° |
| C35 | C34 | C9 | H53 | 180.0° | 179.9° |
| C35 | C34 | C9 | S1 | 179.7° | 180.0° |
| C34 | C9 | S1 | C10 | 127.7° | 7.0° |
| C34 | C9 | C8 | H11 | 180.0° | 180.0° |
| C9 | C34 | C35 | H54 | 179.7° | 179.9° |
| C9 | S1 | C10 | C12 | 128.4° | 68.1° |
| C9 | S1 | C10 | C11 | 106.5° | 172.0° |
| S1 | C9 | C8 | H11 | 0.5° | 0.0° |
| C9 | S1 | C10 | H12 | 11.7° | 51.9° |
| S1 | C9 | C34 | H53 | 0.3° | 0.1° |
| S1 | C10 | C12 | C11 | 127.8° | 120.0° |
| S1 | C10 | C12 | H12 | 114.8° | 120.0° |
| S1 | C10 | C12 | O2 | 144.0° | 25.0° |
| S1 | C10 | C11 | H12 | 116.2° | 120.0° |
| S1 | C10 | C11 | H7 | 180.0° | 64.9° |
| S1 | C10 | C11 | H8 | 60.0° | 55.1° |
| S1 | C10 | C11 | H9 | 60.0° | 175.1° |
| C12 | C10 | C11 | H12 | 117.3° | 120.0° |
| C12 | C10 | C11 | H7 | 53.6° | 55.1° |
| C12 | C10 | C11 | H8 | 66.4° | 175.1° |
| C12 | C10 | C11 | H9 | 173.6° | 64.9° |
| O2 | C12 | C10 | C11 | 16.2° | 95.0° |
| O2 | C12 | C10 | H12 | 101.2° | 145.0° |
| C10 | C11 | H7 | H8 | 120.0° | 120.0° |
| C10 | C11 | H7 | H9 | 120.0° | 120.0° |
| C10 | C11 | H8 | H9 | 120.0° | 120.0° |
| H1 | C4 | C5 | H5 | 30.4° | 60.1° |
| H1 | C4 | C5 | H6 | 150.8° | 180.0° |
| H1 | C4 | C3 | H17 | 43.2° | 180.0° |
| H1 | C4 | C3 | H18 | 161.3° | 60.0° |
| H2 | C4 | C5 | H5 | 88.3° | 180.0° |
| H2 | C4 | C5 | H6 | 32.0° | 60.1° |
| H2 | C4 | C3 | H17 | 161.9° | 60.0° |
| H2 | C4 | C3 | H18 | 79.9° | 180.0° |
| H3 | C14 | C13 | H13 | 178.2° | 59.9° |
| H3 | C14 | C13 | H14 | 63.5° | 180.0° |
| H3 | C14 | N1 | H15 | 123.1° | 120.0° |
| H4 | C14 | C13 | H13 | 59.4° | 180.0° |
| H4 | C14 | C13 | H14 | 177.7° | 59.9° |
| H4 | C14 | N1 | H15 | 4.3° | 120.0° |
| H7 | C11 | H8 | H9 | 120.0° | 119.9° |
| H7 | C11 | C10 | H12 | 63.8° | 175.1° |
| H8 | C11 | C10 | H12 | 176.2° | 64.9° |
| H9 | C11 | C10 | H12 | 56.2° | 55.1° |
| H10 | C7 | C8 | H11 | 0.2° | 0.0° |
| H16 | N2 | C17 | H26 | 130.8° | 120.0° |
| H16 | N2 | C17 | H27 | 11.9° | 120.0° |
| H17 | C3 | C2 | H22 | 72.4° | 180.0° |
| H17 | C3 | C2 | H23 | 46.0° | 60.0° |
| H18 | C3 | C2 | H22 | 169.5° | 60.0° |
| H18 | C3 | C2 | H23 | 72.2° | 180.0° |
| H19 | C1 | H20 | H21 | 120.0° | 120.0° |
| H19 | C1 | C2 | H22 | 59.2° | 180.0° |
| H19 | C1 | C2 | H23 | 59.2° | 60.1° |
| H20 | C1 | C2 | H22 | 179.2° | 60.1° |
| H20 | C1 | C2 | H23 | 60.9° | 180.0° |
| H21 | C1 | C2 | H22 | 60.8° | 60.0° |
| H21 | C1 | C2 | H23 | 179.1° | 60.0° |
| H24 | C16 | C17 | H26 | 35.9° | 59.9° |
| H24 | C16 | C17 | H27 | 154.8° | 180.0° |
| H25 | C16 | C17 | H26 | 83.2° | 180.0° |
| H25 | C16 | C17 | H27 | 35.7° | 59.9° |
| H28 | C19 | O5 | H29 | 8.6° | 180.0° |
| H30 | C21 | H31 | H32 | 120.0° | 120.0° |
| H33 | C22 | H34 | H35 | 120.0° | 120.0° |
| H40 | C24 | C25 | H42 | 165.7° | 174.3° |
| H41 | C24 | C25 | H42 | 45.8° | 65.7° |
| H42 | C25 | C33 | H50 | 105.4° | 123.9° |
| H43 | C26 | C32 | H48 | 166.8° | 160.1° |
| H48 | C32 | O14 | H49 | 59.4° | 62.2° |
| H48 | C32 | C33 | H50 | 36.6° | 21.3° |
| H53 | C34 | C35 | H54 | 0.2° | 0.0° |
