A1AN1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C14 | sing | 1.53Å | 1.53Å | |
| C10 | N3 | sing | 1.46Å | 1.46Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| O1 | C9 | doub | 1.21Å | 1.23Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| O5 | P1 | sing | 1.61Å | 1.52Å | |
| C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| N3 | C9 | sing | 1.35Å | 1.34Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| O4 | P1 | sing | 1.61Å | 1.61Å | |
| O4 | C17 | sing | 1.43Å | 1.46Å | |
| O2 | C12 | doub | 1.21Å | 1.23Å | |
| C14 | C17 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C11 | N4 | sing | 1.46Å | 1.46Å | |
| C38 | C39 | sing | 1.54Å | 1.55Å | |
| C38 | C37 | sing | 1.53Å | 1.53Å | |
| P1 | O6 | doub | 1.48Å | 1.51Å | |
| C39 | C20 | sing | 1.49Å | 1.52Å | |
| C39 | C2 | sing | 1.50Å | 1.52Å | |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| C21 | C22 | sing | 1.52Å | 1.53Å | |
| C7 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | N4 | sing | 1.35Å | 1.33Å | |
| C12 | C13 | sing | 1.51Å | 1.52Å | |
| O16 | P2 | doub | 1.48Å | 1.51Å | |
| C20 | C3 | doub | 1.33Å | 1.35Å | |
| C23 | O8 | sing | 1.45Å | 1.46Å | |
| C23 | C22 | sing | 1.54Å | 1.52Å | |
| C23 | C36 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.48Å | 1.49Å | |
| C4 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O3 | sing | 1.43Å | 1.42Å | |
| O8 | C24 | sing | 1.35Å | 1.35Å | |
| C1 | C2 | sing | 1.51Å | 1.49Å | |
| C3 | N2 | sing | 1.40Å | 1.34Å | |
| C34 | C32 | sing | 1.53Å | 1.53Å | |
| C2 | N1 | doub | 1.27Å | 1.28Å | |
| C35 | O13 | sing | 1.43Å | 1.45Å | |
| C35 | C32 | sing | 1.53Å | 1.52Å | |
| O14 | P2 | sing | 1.61Å | 1.52Å | |
| C37 | C36 | sing | 1.54Å | 1.53Å | |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| P2 | O13 | sing | 1.61Å | 1.61Å | |
| O12 | C31 | sing | 1.43Å | 1.42Å | |
| C32 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | sing | 1.53Å | 1.53Å | |
| N1 | N2 | sing | 1.40Å | 1.37Å | |
| C24 | O9 | doub | 1.21Å | 1.21Å | |
| C24 | N5 | sing | 1.35Å | 1.34Å | |
| C29 | N7 | sing | 1.46Å | 1.46Å | |
| C29 | C28 | sing | 1.53Å | 1.52Å | |
| N7 | C30 | sing | 1.35Å | 1.33Å | |
| C31 | C30 | sing | 1.51Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.51Å | |
| C26 | N6 | sing | 1.47Å | 1.45Å | |
| N5 | C25 | sing | 1.47Å | 1.45Å | |
| C30 | O11 | doub | 1.21Å | 1.23Å | |
| C28 | C27 | sing | 1.51Å | 1.51Å | |
| N6 | C27 | sing | 1.35Å | 1.34Å | |
| C27 | O10 | doub | 1.21Å | 1.23Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| N2 | H4 | sing | 0.97Å | 1.00Å | |
| N3 | H9 | sing | 0.97Å | 1.00Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.08Å | 1.08Å | |
| C19 | H26 | sing | 1.08Å | 1.08Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C25 | H34 | sing | 1.09Å | 1.10Å | |
| C25 | H33 | sing | 1.09Å | 1.10Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C26 | H36 | sing | 1.09Å | 1.10Å | |
| C28 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H38 | sing | 1.09Å | 1.10Å | |
| C29 | H41 | sing | 1.09Å | 1.10Å | |
| C29 | H40 | sing | 1.09Å | 1.10Å | |
| C31 | H43 | sing | 1.09Å | 1.10Å | |
| C33 | H46 | sing | 1.09Å | 1.10Å | |
| C33 | H47 | sing | 1.09Å | 1.10Å | |
| C33 | H45 | sing | 1.09Å | 1.10Å | |
| C34 | H49 | sing | 1.09Å | 1.10Å | |
| C34 | H50 | sing | 1.09Å | 1.10Å | |
| C34 | H48 | sing | 1.09Å | 1.10Å | |
| C35 | H52 | sing | 1.09Å | 1.10Å | |
| C35 | H51 | sing | 1.09Å | 1.10Å | |
| C36 | H53 | sing | 1.09Å | 1.10Å | |
| C36 | H54 | sing | 1.09Å | 1.10Å | |
| C37 | H56 | sing | 1.09Å | 1.10Å | |
| C37 | H55 | sing | 1.09Å | 1.10Å | |
| C38 | H58 | sing | 1.09Å | 1.10Å | |
| C38 | H57 | sing | 1.09Å | 1.10Å | |
| C39 | H59 | sing | 1.09Å | 1.10Å | |
| N4 | H14 | sing | 0.97Å | 1.00Å | |
| N5 | H32 | sing | 0.97Å | 1.00Å | |
| N6 | H37 | sing | 0.97Å | 1.00Å | |
| N7 | H42 | sing | 0.97Å | 1.00Å | |
| O12 | H44 | sing | 0.97Å | 0.95Å | |
| O14 | H62 | sing | 0.97Å | 0.95Å | |
| O3 | H16 | sing | 0.97Å | 0.95Å | |
| O5 | H64 | sing | 0.97Å | 0.95Å | |
| P2 | O7 | sing | 1.61Å | 1.61Å | |
| P1 | O15 | sing | 1.61Å | 1.61Å | |
| O7 | H60 | sing | 0.97Å | 0.95Å | |
| O15 | H61 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C14 | C15 | 109.6° | 109.4° |
| C16 | C14 | C17 | 110.5° | 109.5° |
| C16 | C14 | C13 | 110.8° | 109.5° |
| C14 | C16 | H20 | 109.5° | 109.5° |
| C14 | C16 | H21 | 109.5° | 109.5° |
| C14 | C16 | H22 | 109.4° | 109.4° |
| N3 | C10 | C11 | 110.4° | 109.4° |
| C10 | N3 | C9 | 123.7° | 120.0° |
| N3 | C10 | H10 | 109.3° | 109.5° |
| N3 | C10 | H11 | 109.3° | 109.5° |
| C10 | N3 | H9 | 118.2° | 120.0° |
| C10 | C11 | N4 | 109.3° | 109.5° |
| C10 | C11 | H12 | 109.5° | 109.5° |
| C10 | C11 | H13 | 109.5° | 109.5° |
| C11 | C10 | H10 | 109.2° | 109.5° |
| C11 | C10 | H11 | 109.3° | 109.4° |
| O1 | C9 | N3 | 122.1° | 120.0° |
| O1 | C9 | C8 | 120.7° | 120.0° |
| C15 | C14 | C17 | 107.4° | 109.5° |
| C15 | C14 | C13 | 109.1° | 109.5° |
| C14 | C15 | H19 | 109.5° | 109.4° |
| C14 | C15 | H17 | 109.5° | 109.5° |
| C14 | C15 | H18 | 109.5° | 109.5° |
| O5 | P1 | O4 | 106.5° | 109.5° |
| O5 | P1 | O6 | 114.5° | 109.5° |
| P1 | O5 | H64 | 109.5° | 114.0° |
| O5 | P1 | O15 | 110.0° | 109.5° |
| C5 | C6 | C7 | 121.4° | 120.1° |
| C6 | C5 | C4 | 120.3° | 119.8° |
| C6 | C5 | H5 | 119.8° | 120.1° |
| C5 | C6 | H6 | 119.3° | 119.9° |
| C6 | C7 | C8 | 121.2° | 119.9° |
| C6 | C7 | C18 | 117.9° | 120.3° |
| C7 | C6 | H6 | 119.3° | 120.0° |
| N3 | C9 | C8 | 117.1° | 120.0° |
| C9 | N3 | H9 | 118.1° | 120.0° |
| C9 | C8 | C7 | 112.8° | 109.4° |
| C9 | C8 | H8 | 108.7° | 109.5° |
| C9 | C8 | H7 | 108.6° | 109.4° |
| C5 | C4 | C3 | 121.8° | 120.1° |
| C5 | C4 | C19 | 118.4° | 119.7° |
| C4 | C5 | H5 | 119.8° | 120.1° |
| P1 | O4 | C17 | 120.1° | 123.0° |
| O4 | P1 | O6 | 109.0° | 109.4° |
| O4 | P1 | O15 | 114.4° | 109.5° |
| O4 | C17 | C14 | 108.7° | 109.5° |
| O4 | C17 | H24 | 109.7° | 109.4° |
| O4 | C17 | H23 | 109.7° | 109.5° |
| O2 | C12 | N4 | 122.7° | 120.0° |
| O2 | C12 | C13 | 118.3° | 119.9° |
| C17 | C14 | C13 | 109.4° | 109.5° |
| C14 | C17 | H24 | 109.7° | 109.5° |
| C14 | C17 | H23 | 109.7° | 109.5° |
| C14 | C13 | C12 | 112.6° | 109.4° |
| C14 | C13 | O3 | 110.6° | 109.5° |
| C14 | C13 | H15 | 107.3° | 109.4° |
| C8 | C7 | C18 | 120.9° | 119.8° |
| C7 | C8 | H8 | 108.6° | 109.5° |
| C7 | C8 | H7 | 108.7° | 109.5° |
| C11 | N4 | C12 | 121.6° | 120.0° |
| N4 | C11 | H12 | 109.5° | 109.4° |
| N4 | C11 | H13 | 109.5° | 109.5° |
| C11 | N4 | H14 | 119.2° | 120.0° |
| C39 | C38 | C37 | 116.0° | 109.3° |
| C38 | C39 | C20 | 115.1° | 107.9° |
| C38 | C39 | C2 | 108.6° | 109.6° |
| C39 | C38 | H58 | 107.8° | 109.5° |
| C39 | C38 | H57 | 107.8° | 109.5° |
| C38 | C39 | H59 | 107.6° | 109.4° |
| C38 | C37 | C36 | 115.0° | 110.4° |
| C38 | C37 | H56 | 108.1° | 109.3° |
| C38 | C37 | H55 | 108.1° | 109.1° |
| C37 | C38 | H58 | 107.8° | 109.5° |
| C37 | C38 | H57 | 107.8° | 109.5° |
| O6 | P1 | O15 | 102.6° | 109.5° |
| C20 | C39 | C2 | 109.4° | 111.6° |
| C39 | C20 | C21 | 118.8° | 119.2° |
| C39 | C20 | C3 | 115.8° | 121.2° |
| C20 | C39 | H59 | 107.9° | 109.3° |
| C39 | C2 | C1 | 116.5° | 118.9° |
| C39 | C2 | N1 | 125.7° | 122.2° |
| C2 | C39 | H59 | 108.0° | 109.0° |
| C20 | C21 | C22 | 114.1° | 109.1° |
| C21 | C20 | C3 | 125.3° | 119.6° |
| C20 | C21 | H28 | 108.3° | 109.6° |
| C20 | C21 | H27 | 108.3° | 109.6° |
| C21 | C22 | C23 | 113.5° | 109.2° |
| C22 | C21 | H28 | 108.3° | 109.6° |
| C22 | C21 | H27 | 108.3° | 109.5° |
| C21 | C22 | H29 | 108.5° | 109.5° |
| C21 | C22 | H30 | 108.5° | 109.5° |
| C7 | C18 | C19 | 121.2° | 120.1° |
| C7 | C18 | H25 | 119.4° | 120.0° |
| N4 | C12 | C13 | 118.5° | 120.0° |
| C12 | N4 | H14 | 119.2° | 120.0° |
| C12 | C13 | O3 | 109.9° | 109.5° |
| C12 | C13 | H15 | 107.5° | 109.4° |
| O16 | P2 | O14 | 113.5° | 109.5° |
| O16 | P2 | O13 | 107.6° | 109.5° |
| O16 | P2 | O7 | 113.6° | 109.4° |
| C20 | C3 | C4 | 123.6° | 120.2° |
| C20 | C3 | N2 | 118.5° | 119.5° |
| O8 | C23 | C22 | 108.2° | 109.5° |
| O8 | C23 | C36 | 110.2° | 109.5° |
| C23 | O8 | C24 | 119.9° | 117.0° |
| O8 | C23 | H31 | 109.0° | 109.5° |
| C22 | C23 | C36 | 113.0° | 109.3° |
| C23 | C22 | H29 | 108.4° | 109.5° |
| C23 | C22 | H30 | 108.4° | 109.6° |
| C22 | C23 | H31 | 108.2° | 109.5° |
| C23 | C36 | C37 | 114.9° | 111.0° |
| C36 | C23 | H31 | 108.2° | 109.5° |
| C23 | C36 | H53 | 108.1° | 109.2° |
| C23 | C36 | H54 | 108.1° | 109.2° |
| C3 | C4 | C19 | 119.8° | 120.1° |
| C4 | C3 | N2 | 117.6° | 120.2° |
| C4 | C19 | C18 | 120.7° | 119.9° |
| C4 | C19 | H26 | 119.6° | 120.0° |
| O3 | C13 | H15 | 108.8° | 109.5° |
| C13 | O3 | H16 | 109.5° | 114.0° |
| O8 | C24 | O9 | 125.1° | 119.9° |
| O8 | C24 | N5 | 110.4° | 120.0° |
| C1 | C2 | N1 | 117.7° | 118.9° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C3 | N2 | N1 | 124.3° | 119.6° |
| C3 | N2 | H4 | 117.8° | 120.1° |
| C34 | C32 | C35 | 108.7° | 109.5° |
| C34 | C32 | C31 | 109.2° | 109.4° |
| C34 | C32 | C33 | 108.2° | 109.5° |
| C32 | C34 | H49 | 109.5° | 109.5° |
| C32 | C34 | H50 | 109.4° | 109.4° |
| C32 | C34 | H48 | 109.5° | 109.5° |
| C2 | N1 | N2 | 116.6° | 121.1° |
| O13 | C35 | C32 | 108.3° | 109.5° |
| C35 | O13 | P2 | 118.8° | 123.0° |
| O13 | C35 | H52 | 109.8° | 109.5° |
| O13 | C35 | H51 | 109.8° | 109.4° |
| C35 | C32 | C31 | 111.5° | 109.5° |
| C35 | C32 | C33 | 109.6° | 109.5° |
| C32 | C35 | H52 | 109.7° | 109.5° |
| C32 | C35 | H51 | 109.8° | 109.5° |
| O14 | P2 | O13 | 107.4° | 109.5° |
| P2 | O14 | H62 | 109.5° | 114.0° |
| O14 | P2 | O7 | 106.7° | 109.5° |
| C37 | C36 | H53 | 108.1° | 109.2° |
| C37 | C36 | H54 | 108.1° | 109.1° |
| C36 | C37 | H56 | 108.1° | 109.3° |
| C36 | C37 | H55 | 108.1° | 109.4° |
| C19 | C18 | H25 | 119.4° | 120.0° |
| C18 | C19 | H26 | 119.6° | 120.1° |
| O13 | P2 | O7 | 107.8° | 109.5° |
| O12 | C31 | C32 | 109.7° | 109.4° |
| O12 | C31 | C30 | 110.1° | 109.5° |
| O12 | C31 | H43 | 109.2° | 109.5° |
| C31 | O12 | H44 | 109.5° | 114.1° |
| C31 | C32 | C33 | 109.5° | 109.4° |
| C32 | C31 | C30 | 112.4° | 109.5° |
| C32 | C31 | H43 | 107.7° | 109.5° |
| C32 | C33 | H46 | 109.5° | 109.5° |
| C32 | C33 | H47 | 109.5° | 109.4° |
| C32 | C33 | H45 | 109.4° | 109.5° |
| N1 | N2 | H4 | 117.9° | 120.2° |
| O9 | C24 | N5 | 124.5° | 120.0° |
| C24 | N5 | C25 | 121.7° | 120.0° |
| C24 | N5 | H32 | 119.1° | 120.1° |
| N7 | C29 | C28 | 112.8° | 109.5° |
| C29 | N7 | C30 | 122.6° | 120.1° |
| N7 | C29 | H41 | 108.6° | 109.5° |
| N7 | C29 | H40 | 108.6° | 109.5° |
| C29 | N7 | H42 | 118.7° | 120.0° |
| C29 | C28 | C27 | 112.6° | 109.5° |
| C29 | C28 | H39 | 108.7° | 109.5° |
| C29 | C28 | H38 | 108.7° | 109.5° |
| C28 | C29 | H41 | 108.6° | 109.5° |
| C28 | C29 | H40 | 108.6° | 109.5° |
| N7 | C30 | C31 | 117.6° | 120.1° |
| N7 | C30 | O11 | 122.9° | 120.0° |
| C30 | N7 | H42 | 118.7° | 119.9° |
| C31 | C30 | O11 | 119.5° | 120.0° |
| C30 | C31 | H43 | 107.8° | 109.5° |
| C25 | C26 | N6 | 111.9° | 109.5° |
| C26 | C25 | N5 | 113.6° | 109.5° |
| C26 | C25 | H34 | 108.4° | 109.5° |
| C26 | C25 | H33 | 108.4° | 109.5° |
| C25 | C26 | H35 | 108.9° | 109.5° |
| C25 | C26 | H36 | 108.9° | 109.5° |
| C26 | N6 | C27 | 124.1° | 120.0° |
| N6 | C26 | H35 | 108.9° | 109.5° |
| N6 | C26 | H36 | 108.9° | 109.5° |
| C26 | N6 | H37 | 117.9° | 120.0° |
| N5 | C25 | H34 | 108.4° | 109.4° |
| N5 | C25 | H33 | 108.4° | 109.4° |
| C25 | N5 | H32 | 119.1° | 119.9° |
| C28 | C27 | N6 | 116.5° | 120.0° |
| C28 | C27 | O10 | 121.3° | 120.0° |
| C27 | C28 | H39 | 108.7° | 109.4° |
| C27 | C28 | H38 | 108.7° | 109.5° |
| N6 | C27 | O10 | 122.2° | 120.0° |
| C27 | N6 | H37 | 118.0° | 120.0° |
| H12 | C11 | H13 | 109.5° | 109.4° |
| H8 | C8 | H7 | 109.5° | 109.5° |
| H10 | C10 | H11 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H19 | C15 | H17 | 109.4° | 109.5° |
| H19 | C15 | H18 | 109.5° | 109.4° |
| H17 | C15 | H18 | 109.5° | 109.5° |
| H20 | C16 | H21 | 109.4° | 109.5° |
| H20 | C16 | H22 | 109.5° | 109.5° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H24 | C17 | H23 | 109.5° | 109.5° |
| H28 | C21 | H27 | 109.5° | 109.6° |
| H29 | C22 | H30 | 109.5° | 109.5° |
| H34 | C25 | H33 | 109.5° | 109.4° |
| H35 | C26 | H36 | 109.5° | 109.5° |
| H39 | C28 | H38 | 109.5° | 109.4° |
| H41 | C29 | H40 | 109.5° | 109.5° |
| H46 | C33 | H47 | 109.5° | 109.5° |
| H46 | C33 | H45 | 109.5° | 109.4° |
| H47 | C33 | H45 | 109.5° | 109.5° |
| H49 | C34 | H50 | 109.5° | 109.4° |
| H49 | C34 | H48 | 109.5° | 109.5° |
| H50 | C34 | H48 | 109.5° | 109.5° |
| H52 | C35 | H51 | 109.5° | 109.4° |
| H53 | C36 | H54 | 109.5° | 109.2° |
| H56 | C37 | H55 | 109.4° | 109.3° |
| H58 | C38 | H57 | 109.4° | 109.5° |
| P2 | O7 | H60 | 109.5° | 114.0° |
| P1 | O15 | H61 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C14 | C15 | C17 | 120.0° | 120.0° |
| C16 | C14 | C15 | C13 | 121.5° | 120.0° |
| C16 | C14 | C17 | O4 | 81.7° | 60.0° |
| C16 | C14 | C17 | C13 | 122.2° | 120.0° |
| C16 | C14 | C13 | C12 | 38.0° | 65.6° |
| C16 | C14 | C13 | O3 | 161.5° | 174.4° |
| C16 | C14 | C13 | H15 | 80.0° | 54.3° |
| C16 | C14 | C15 | H19 | 180.0° | 176.6° |
| C16 | C14 | C15 | H17 | 60.0° | 56.6° |
| C16 | C14 | C15 | H18 | 60.0° | 63.4° |
| C14 | C16 | H20 | H21 | 120.0° | 120.0° |
| C14 | C16 | H20 | H22 | 120.0° | 120.0° |
| C14 | C16 | H21 | H22 | 120.0° | 120.0° |
| C16 | C14 | C17 | H24 | 38.1° | 60.0° |
| C16 | C14 | C17 | H23 | 158.4° | 180.0° |
| N3 | C10 | C11 | H10 | 120.1° | 120.0° |
| N3 | C10 | C11 | H11 | 120.2° | 120.0° |
| C10 | N3 | C9 | O1 | 134.7° | 0.1° |
| C10 | N3 | C9 | H9 | 180.0° | 179.9° |
| C10 | N3 | C9 | C8 | 49.0° | 180.0° |
| N3 | C10 | C11 | N4 | 51.0° | 180.0° |
| N3 | C10 | C11 | H12 | 69.0° | 60.0° |
| N3 | C10 | C11 | H13 | 171.0° | 60.0° |
| N3 | C10 | H10 | H11 | 119.6° | 120.0° |
| C11 | C10 | N3 | C9 | 104.6° | 179.9° |
| C10 | C11 | N4 | H12 | 120.0° | 120.0° |
| C10 | C11 | N4 | H13 | 120.0° | 120.1° |
| C10 | C11 | N4 | C12 | 55.3° | 180.0° |
| C10 | C11 | H12 | H13 | 120.1° | 120.0° |
| C11 | C10 | H10 | H11 | 119.6° | 120.0° |
| C11 | C10 | N3 | H9 | 75.4° | 0.0° |
| C10 | C11 | N4 | H14 | 124.7° | 0.0° |
| O1 | C9 | N3 | C8 | 176.3° | 179.9° |
| O1 | C9 | C8 | C7 | 11.2° | 0.1° |
| O1 | C9 | C8 | H8 | 109.3° | 120.0° |
| O1 | C9 | C8 | H7 | 131.7° | 120.0° |
| O1 | C9 | N3 | H9 | 45.3° | 180.0° |
| C15 | C14 | C17 | O4 | 37.7° | 60.0° |
| C15 | C14 | C17 | C13 | 118.3° | 120.0° |
| C15 | C14 | C13 | C12 | 82.7° | 174.5° |
| C15 | C14 | C13 | O3 | 40.7° | 54.4° |
| C15 | C14 | C13 | H15 | 159.3° | 65.6° |
| C14 | C15 | H19 | H17 | 120.0° | 120.1° |
| C14 | C15 | H19 | H18 | 120.0° | 120.0° |
| C14 | C15 | H17 | H18 | 120.0° | 120.0° |
| C15 | C14 | C16 | H20 | 180.0° | 52.5° |
| C15 | C14 | C16 | H21 | 60.0° | 67.5° |
| C15 | C14 | C16 | H22 | 60.0° | 172.6° |
| C15 | C14 | C17 | H24 | 157.6° | 179.9° |
| C15 | C14 | C17 | H23 | 82.1° | 60.1° |
| O5 | P1 | O4 | O6 | 124.1° | 120.0° |
| O5 | P1 | O4 | O15 | 121.8° | 120.1° |
| O5 | P1 | O4 | C17 | 152.8° | 65.0° |
| O5 | P1 | O6 | O15 | 119.2° | 120.0° |
| O5 | P1 | O15 | H61 | 122.3° | 60.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 179.8° | 179.9° |
| C5 | C6 | C7 | C18 | 0.6° | 0.0° |
| C6 | C5 | C4 | C3 | 179.3° | 180.0° |
| C6 | C5 | C4 | C19 | 0.9° | 0.3° |
| C6 | C7 | C8 | C9 | 74.1° | 90.0° |
| C7 | C6 | C5 | C4 | 0.8° | 0.0° |
| C6 | C7 | C8 | C18 | 179.2° | 180.0° |
| C6 | C7 | C18 | C19 | 0.5° | 0.3° |
| C7 | C6 | C5 | H5 | 179.2° | 180.0° |
| C6 | C7 | C8 | H8 | 46.4° | 150.0° |
| C6 | C7 | C8 | H7 | 165.4° | 29.9° |
| C6 | C7 | C18 | H25 | 179.6° | 180.0° |
| N3 | C9 | C8 | C7 | 165.1° | 180.0° |
| N3 | C9 | C8 | H8 | 74.4° | 59.9° |
| N3 | C9 | C8 | H7 | 44.6° | 60.1° |
| C9 | N3 | C10 | H10 | 15.5° | 60.1° |
| C9 | N3 | C10 | H11 | 135.2° | 60.0° |
| C9 | C8 | C7 | H8 | 120.5° | 120.0° |
| C9 | C8 | C7 | H7 | 120.5° | 119.9° |
| C9 | C8 | C7 | C18 | 106.7° | 90.0° |
| C9 | C8 | H8 | H7 | 118.5° | 120.0° |
| C8 | C9 | N3 | H9 | 131.0° | 0.1° |
| C5 | C4 | C3 | C20 | 35.0° | 124.6° |
| C5 | C4 | C3 | C19 | 178.4° | 179.7° |
| C5 | C4 | C3 | N2 | 138.7° | 55.4° |
| C5 | C4 | C19 | C18 | 0.8° | 0.6° |
| C4 | C5 | C6 | H6 | 179.2° | 180.0° |
| C5 | C4 | C19 | H26 | 179.2° | 179.7° |
| P1 | O4 | C17 | C14 | 133.4° | 180.0° |
| O4 | P1 | O6 | O15 | 121.6° | 120.0° |
| P1 | O4 | C17 | H24 | 106.8° | 60.0° |
| P1 | O4 | C17 | H23 | 13.5° | 60.0° |
| O4 | P1 | O5 | H64 | 120.6° | 60.1° |
| O4 | P1 | O15 | H61 | 117.9° | 180.0° |
| O4 | C17 | C14 | H24 | 119.8° | 120.0° |
| O4 | C17 | C14 | H23 | 119.9° | 120.0° |
| O4 | C17 | C14 | C13 | 156.1° | 180.0° |
| C17 | O4 | P1 | O6 | 28.7° | 55.0° |
| O4 | C17 | H24 | H23 | 120.4° | 120.0° |
| C17 | O4 | P1 | O15 | 85.4° | 175.0° |
| O2 | C12 | C13 | C14 | 66.4° | 107.9° |
| O2 | C12 | N4 | C11 | 72.2° | 4.9° |
| O2 | C12 | N4 | C13 | 171.1° | 179.9° |
| O2 | C12 | C13 | O3 | 57.4° | 12.1° |
| O2 | C12 | C13 | H15 | 175.6° | 132.1° |
| O2 | C12 | N4 | H14 | 107.8° | 175.1° |
| C17 | C14 | C13 | C12 | 160.1° | 54.4° |
| C17 | C14 | C13 | O3 | 76.5° | 65.6° |
| C17 | C14 | C13 | H15 | 42.0° | 174.4° |
| C17 | C14 | C15 | H19 | 59.9° | 63.4° |
| C17 | C14 | C15 | H17 | 60.0° | 176.6° |
| C17 | C14 | C15 | H18 | 180.0° | 56.5° |
| C17 | C14 | C16 | H20 | 61.9° | 67.5° |
| C17 | C14 | C16 | H21 | 178.1° | 172.5° |
| C17 | C14 | C16 | H22 | 58.1° | 52.6° |
| C14 | C17 | H24 | H23 | 120.4° | 120.0° |
| C14 | C13 | C12 | N4 | 122.1° | 72.1° |
| C14 | C13 | C12 | O3 | 123.8° | 120.0° |
| C14 | C13 | C12 | H15 | 118.0° | 119.9° |
| C14 | C13 | O3 | H15 | 117.6° | 120.0° |
| C13 | C14 | C15 | H19 | 58.6° | 56.6° |
| C13 | C14 | C15 | H17 | 178.5° | 63.4° |
| C13 | C14 | C15 | H18 | 61.5° | 176.6° |
| C13 | C14 | C16 | H20 | 59.5° | 172.5° |
| C13 | C14 | C16 | H21 | 60.5° | 52.5° |
| C13 | C14 | C16 | H22 | 179.5° | 67.4° |
| C13 | C14 | C17 | H24 | 84.1° | 60.0° |
| C13 | C14 | C17 | H23 | 36.2° | 60.0° |
| C14 | C13 | O3 | H16 | 102.2° | 60.0° |
| C8 | C7 | C18 | C19 | 179.6° | 179.6° |
| C8 | C7 | C6 | H6 | 0.2° | 0.0° |
| C7 | C8 | H8 | H7 | 118.5° | 120.0° |
| C8 | C7 | C18 | H25 | 0.4° | 0.0° |
| C11 | N4 | C12 | H14 | 180.0° | 180.0° |
| C11 | N4 | C12 | C13 | 116.7° | 175.1° |
| N4 | C11 | H12 | H13 | 120.1° | 120.0° |
| N4 | C11 | C10 | H10 | 171.2° | 60.0° |
| N4 | C11 | C10 | H11 | 69.1° | 60.1° |
| C39 | C38 | C37 | H58 | 121.0° | 120.0° |
| C39 | C38 | C37 | H57 | 121.0° | 119.9° |
| C38 | C39 | C20 | C2 | 122.6° | 120.5° |
| C38 | C39 | C20 | H59 | 120.2° | 118.9° |
| C38 | C39 | C2 | H59 | 116.4° | 119.7° |
| C38 | C39 | C20 | C21 | 24.9° | 42.8° |
| C38 | C39 | C20 | C3 | 151.6° | 137.2° |
| C38 | C39 | C2 | C1 | 44.8° | 43.7° |
| C38 | C39 | C2 | N1 | 137.1° | 136.3° |
| C39 | C38 | C37 | C36 | 119.7° | 73.5° |
| C39 | C38 | C37 | H56 | 1.1° | 166.3° |
| C39 | C38 | C37 | H55 | 119.5° | 46.7° |
| C39 | C38 | H58 | H57 | 117.0° | 120.1° |
| C37 | C38 | C39 | C20 | 68.3° | 77.1° |
| C37 | C38 | C39 | C2 | 54.7° | 44.7° |
| C38 | C37 | C36 | C23 | 40.4° | 44.8° |
| C38 | C37 | C36 | H56 | 120.8° | 120.3° |
| C38 | C37 | C36 | H55 | 120.8° | 120.1° |
| C38 | C37 | C36 | H53 | 80.3° | 165.1° |
| C38 | C37 | C36 | H54 | 161.2° | 75.6° |
| C38 | C37 | H56 | H55 | 117.5° | 119.4° |
| C37 | C38 | H58 | H57 | 117.0° | 120.1° |
| C37 | C38 | C39 | H59 | 171.3° | 164.1° |
| O6 | P1 | O5 | H64 | 0.0° | 180.0° |
| O6 | P1 | O15 | H61 | 0.0° | 60.0° |
| C20 | C39 | C2 | H59 | 117.2° | 120.8° |
| C39 | C20 | C21 | C3 | 176.1° | 179.9° |
| C39 | C20 | C21 | C22 | 82.1° | 111.0° |
| C39 | C20 | C3 | C4 | 136.1° | 179.4° |
| C20 | C39 | C2 | C1 | 171.2° | 163.2° |
| C39 | C20 | C3 | N2 | 37.5° | 0.6° |
| C20 | C39 | C2 | N1 | 10.7° | 16.8° |
| C39 | C20 | C21 | H28 | 38.6° | 9.0° |
| C39 | C20 | C21 | H27 | 157.2° | 129.2° |
| C20 | C39 | C38 | H58 | 170.7° | 42.9° |
| C20 | C39 | C38 | H57 | 52.6° | 163.0° |
| C2 | C39 | C20 | C21 | 147.5° | 163.3° |
| C2 | C39 | C20 | C3 | 29.0° | 16.7° |
| C39 | C2 | C1 | N1 | 178.2° | 180.0° |
| C39 | C2 | N1 | N2 | 0.8° | 0.3° |
| C39 | C2 | C1 | H1 | 178.3° | 116.0° |
| C39 | C2 | C1 | H2 | 58.3° | 3.9° |
| C39 | C2 | C1 | H3 | 61.8° | 123.9° |
| C2 | C39 | C38 | H58 | 66.3° | 164.7° |
| C2 | C39 | C38 | H57 | 175.6° | 75.2° |
| C20 | C21 | C22 | H28 | 120.7° | 119.9° |
| C20 | C21 | C22 | H27 | 120.7° | 119.9° |
| C20 | C21 | C22 | C23 | 104.3° | 72.5° |
| C21 | C20 | C3 | C4 | 47.7° | 0.6° |
| C21 | C20 | C3 | N2 | 138.7° | 179.4° |
| C20 | C21 | H28 | H27 | 117.9° | 120.2° |
| C20 | C21 | C22 | H29 | 135.1° | 167.5° |
| C20 | C21 | C22 | H30 | 16.3° | 47.4° |
| C21 | C20 | C39 | H59 | 95.3° | 76.1° |
| C22 | C21 | C20 | C3 | 94.0° | 69.1° |
| C21 | C22 | C23 | O8 | 134.0° | 162.0° |
| C21 | C22 | C23 | H29 | 120.6° | 119.9° |
| C21 | C22 | C23 | H30 | 120.6° | 119.9° |
| C21 | C22 | C23 | C36 | 103.7° | 78.1° |
| C22 | C21 | H28 | H27 | 117.9° | 120.1° |
| C21 | C22 | H29 | H30 | 118.2° | 120.1° |
| C21 | C22 | C23 | H31 | 16.0° | 41.9° |
| C7 | C18 | C19 | C4 | 0.5° | 0.6° |
| C7 | C18 | C19 | H25 | 180.0° | 179.7° |
| C18 | C7 | C6 | H6 | 179.4° | 180.0° |
| C18 | C7 | C8 | H8 | 132.8° | 30.0° |
| C18 | C7 | C8 | H7 | 13.8° | 150.1° |
| C7 | C18 | C19 | H26 | 179.4° | 179.7° |
| N4 | C12 | C13 | O3 | 114.1° | 167.9° |
| C12 | N4 | C11 | H12 | 175.3° | 60.0° |
| C12 | N4 | C11 | H13 | 64.7° | 60.0° |
| N4 | C12 | C13 | H15 | 4.1° | 47.8° |
| C12 | C13 | O3 | H15 | 117.4° | 120.0° |
| C13 | C12 | N4 | H14 | 63.3° | 4.9° |
| C12 | C13 | O3 | H16 | 22.7° | 60.0° |
| O16 | P2 | O13 | C35 | 73.4° | 55.1° |
| O16 | P2 | O14 | O13 | 118.8° | 120.0° |
| O16 | P2 | O14 | O7 | 125.8° | 120.0° |
| O16 | P2 | O13 | O7 | 122.9° | 119.9° |
| O16 | P2 | O14 | H62 | 0.0° | 180.0° |
| O16 | P2 | O7 | H60 | 0.0° | 60.0° |
| C20 | C3 | C4 | N2 | 173.7° | 180.0° |
| C20 | C3 | C4 | C19 | 146.6° | 55.7° |
| C20 | C3 | N2 | N1 | 26.2° | 17.6° |
| C20 | C3 | N2 | H4 | 153.8° | 162.4° |
| C3 | C20 | C21 | H28 | 145.3° | 171.0° |
| C3 | C20 | C21 | H27 | 26.7° | 50.7° |
| C3 | C20 | C39 | H59 | 88.3° | 103.9° |
| O8 | C23 | C22 | C36 | 122.3° | 120.0° |
| O8 | C23 | C22 | H31 | 117.9° | 120.1° |
| O8 | C23 | C36 | H31 | 119.0° | 120.0° |
| O8 | C23 | C36 | C37 | 169.9° | 125.8° |
| C23 | O8 | C24 | O9 | 107.5° | 0.0° |
| C23 | O8 | C24 | N5 | 70.5° | 180.0° |
| O8 | C23 | C22 | H29 | 13.4° | 42.1° |
| O8 | C23 | C22 | H30 | 105.4° | 78.1° |
| O8 | C23 | C36 | H53 | 69.3° | 5.4° |
| O8 | C23 | C36 | H54 | 49.1° | 113.9° |
| C22 | C23 | C36 | H31 | 119.8° | 120.0° |
| C22 | C23 | O8 | C24 | 93.8° | 90.0° |
| C22 | C23 | C36 | C37 | 48.8° | 114.2° |
| C23 | C22 | C21 | H28 | 16.4° | 47.4° |
| C23 | C22 | C21 | H27 | 135.0° | 167.6° |
| C23 | C22 | H29 | H30 | 118.2° | 120.2° |
| C22 | C23 | C36 | H53 | 169.5° | 125.4° |
| C22 | C23 | C36 | H54 | 72.0° | 6.1° |
| C36 | C23 | O8 | C24 | 30.2° | 150.1° |
| C23 | C36 | C37 | H53 | 120.8° | 120.4° |
| C23 | C36 | C37 | H54 | 120.8° | 120.4° |
| C36 | C23 | C22 | H29 | 135.7° | 162.0° |
| C36 | C23 | C22 | H30 | 16.8° | 41.8° |
| C23 | C36 | H53 | H54 | 117.5° | 119.3° |
| C23 | C36 | C37 | H56 | 80.4° | 75.5° |
| C23 | C36 | C37 | H55 | 161.3° | 164.8° |
| C3 | C4 | C19 | C18 | 179.2° | 179.7° |
| C4 | C3 | N2 | N1 | 147.8° | 162.4° |
| C3 | C4 | C5 | H5 | 0.7° | 0.0° |
| C4 | C3 | N2 | H4 | 32.2° | 17.6° |
| C3 | C4 | C19 | H26 | 0.8° | 0.0° |
| C19 | C4 | C3 | N2 | 39.7° | 124.3° |
| C4 | C19 | C18 | H26 | 180.0° | 179.7° |
| C19 | C4 | C5 | H5 | 179.1° | 179.7° |
| C4 | C19 | C18 | H25 | 179.5° | 179.7° |
| O8 | C24 | O9 | N5 | 177.7° | 180.0° |
| O8 | C24 | N5 | C25 | 72.9° | 180.0° |
| C24 | O8 | C23 | H31 | 148.8° | 30.1° |
| O8 | C24 | N5 | H32 | 107.1° | 0.0° |
| C1 | C2 | N1 | N2 | 177.3° | 179.7° |
| C2 | C1 | H1 | H2 | 120.0° | 119.9° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 119.9° |
| C1 | C2 | C39 | H59 | 71.6° | 76.0° |
| C3 | N2 | N1 | C2 | 5.6° | 18.0° |
| C3 | N2 | N1 | H4 | 180.0° | 180.0° |
| C34 | C32 | C35 | O13 | 151.0° | 60.1° |
| C34 | C32 | C35 | C31 | 120.4° | 120.0° |
| C34 | C32 | C35 | C33 | 118.1° | 120.1° |
| C34 | C32 | C31 | O12 | 42.6° | 174.5° |
| C34 | C32 | C31 | C33 | 118.3° | 120.0° |
| C34 | C32 | C31 | C30 | 165.3° | 65.5° |
| C34 | C32 | C31 | H43 | 76.1° | 54.4° |
| C34 | C32 | C33 | H46 | 180.0° | 56.5° |
| C34 | C32 | C33 | H47 | 60.0° | 63.5° |
| C34 | C32 | C33 | H45 | 60.0° | 176.5° |
| C32 | C34 | H49 | H50 | 120.0° | 119.9° |
| C32 | C34 | H49 | H48 | 120.0° | 120.1° |
| C32 | C34 | H50 | H48 | 120.0° | 120.0° |
| C34 | C32 | C35 | H52 | 31.2° | 60.0° |
| C34 | C32 | C35 | H51 | 89.1° | 179.9° |
| C2 | N1 | N2 | H4 | 174.4° | 162.0° |
| N1 | C2 | C1 | H1 | 0.0° | 64.0° |
| N1 | C2 | C1 | H2 | 120.0° | 176.1° |
| N1 | C2 | C1 | H3 | 120.0° | 56.1° |
| N1 | C2 | C39 | H59 | 106.4° | 104.0° |
| O13 | C35 | C32 | H52 | 119.8° | 120.0° |
| O13 | C35 | C32 | H51 | 119.8° | 120.0° |
| C35 | O13 | P2 | O14 | 49.2° | 64.9° |
| O13 | C35 | C32 | C31 | 88.5° | 180.0° |
| O13 | C35 | C32 | C33 | 32.9° | 60.0° |
| O13 | C35 | H52 | H51 | 120.6° | 120.0° |
| C35 | O13 | P2 | O7 | 163.8° | 175.0° |
| C32 | C35 | O13 | P2 | 126.4° | 180.0° |
| C35 | C32 | C31 | O12 | 77.6° | 65.5° |
| C35 | C32 | C31 | C33 | 121.5° | 120.0° |
| C35 | C32 | C31 | C30 | 45.2° | 54.5° |
| C35 | C32 | C31 | H43 | 163.8° | 174.4° |
| C35 | C32 | C33 | H46 | 61.6° | 176.6° |
| C35 | C32 | C33 | H47 | 58.4° | 56.6° |
| C35 | C32 | C33 | H45 | 178.4° | 63.4° |
| C35 | C32 | C34 | H49 | 180.0° | 52.4° |
| C35 | C32 | C34 | H50 | 60.0° | 67.5° |
| C35 | C32 | C34 | H48 | 60.0° | 172.5° |
| C32 | C35 | H52 | H51 | 120.5° | 120.0° |
| O14 | P2 | O13 | O7 | 114.6° | 120.0° |
| O14 | P2 | O7 | H60 | 125.8° | 59.9° |
| C37 | C36 | C23 | H31 | 71.0° | 5.7° |
| C37 | C36 | H53 | H54 | 117.6° | 119.2° |
| C36 | C37 | H56 | H55 | 117.5° | 119.7° |
| C36 | C37 | C38 | H58 | 119.4° | 46.5° |
| C36 | C37 | C38 | H57 | 1.3° | 166.6° |
| P2 | O13 | C35 | H52 | 6.6° | 59.9° |
| P2 | O13 | C35 | H51 | 113.8° | 60.0° |
| O13 | P2 | O14 | H62 | 118.8° | 60.0° |
| O13 | P2 | O7 | H60 | 119.1° | 180.0° |
| O12 | C31 | C32 | C30 | 122.8° | 120.0° |
| O12 | C31 | C32 | H43 | 118.7° | 120.0° |
| O12 | C31 | C32 | C33 | 160.9° | 54.5° |
| O12 | C31 | C30 | N7 | 27.6° | 168.0° |
| O12 | C31 | C30 | H43 | 119.0° | 120.1° |
| O12 | C31 | C30 | O11 | 152.6° | 12.1° |
| C32 | C31 | C30 | N7 | 95.0° | 72.1° |
| C32 | C31 | C30 | H43 | 118.5° | 120.0° |
| C32 | C31 | C30 | O11 | 84.8° | 107.9° |
| C31 | C32 | C33 | H46 | 61.1° | 63.4° |
| C31 | C32 | C33 | H47 | 178.9° | 176.6° |
| C31 | C32 | C33 | H45 | 58.9° | 56.5° |
| C31 | C32 | C34 | H49 | 58.2° | 67.5° |
| C31 | C32 | C34 | H50 | 178.2° | 172.6° |
| C31 | C32 | C34 | H48 | 61.8° | 52.5° |
| C31 | C32 | C35 | H52 | 151.6° | 60.0° |
| C31 | C32 | C35 | H51 | 31.3° | 60.0° |
| C32 | C31 | O12 | H44 | 180.0° | 60.0° |
| C33 | C32 | C31 | C30 | 76.4° | 174.5° |
| C33 | C32 | C31 | H43 | 42.2° | 65.6° |
| C32 | C33 | H46 | H47 | 120.0° | 120.0° |
| C32 | C33 | H46 | H45 | 120.0° | 120.0° |
| C32 | C33 | H47 | H45 | 120.0° | 120.0° |
| C33 | C32 | C34 | H49 | 61.0° | 172.5° |
| C33 | C32 | C34 | H50 | 59.0° | 52.6° |
| C33 | C32 | C34 | H48 | 179.0° | 67.4° |
| C33 | C32 | C35 | H52 | 86.9° | 180.0° |
| C33 | C32 | C35 | H51 | 152.8° | 60.0° |
| O9 | C24 | N5 | C25 | 109.1° | 0.0° |
| O9 | C24 | N5 | H32 | 70.9° | 180.0° |
| C24 | N5 | C25 | C26 | 35.6° | 180.0° |
| C24 | N5 | C25 | H32 | 180.0° | 180.0° |
| C24 | N5 | C25 | H34 | 156.2° | 60.0° |
| C24 | N5 | C25 | H33 | 85.0° | 60.0° |
| N7 | C29 | C28 | H41 | 120.5° | 120.0° |
| N7 | C29 | C28 | H40 | 120.5° | 120.0° |
| C29 | N7 | C30 | H42 | 180.0° | 179.9° |
| C29 | N7 | C30 | C31 | 89.1° | 175.1° |
| C29 | N7 | C30 | O11 | 91.1° | 4.9° |
| N7 | C29 | C28 | C27 | 99.3° | 180.0° |
| N7 | C29 | C28 | H39 | 140.3° | 60.0° |
| N7 | C29 | C28 | H38 | 21.2° | 60.0° |
| N7 | C29 | H41 | H40 | 118.5° | 120.0° |
| C28 | C29 | N7 | C30 | 52.1° | 180.0° |
| C29 | C28 | C27 | H39 | 120.4° | 120.0° |
| C29 | C28 | C27 | H38 | 120.5° | 120.0° |
| C29 | C28 | C27 | N6 | 34.6° | 180.0° |
| C29 | C28 | C27 | O10 | 144.5° | 0.0° |
| C29 | C28 | H39 | H38 | 118.6° | 120.0° |
| C28 | C29 | H41 | H40 | 118.5° | 120.0° |
| C28 | C29 | N7 | H42 | 127.9° | 0.0° |
| N7 | C30 | C31 | O11 | 179.8° | 180.0° |
| C30 | N7 | C29 | H41 | 68.4° | 60.1° |
| C30 | N7 | C29 | H40 | 172.6° | 60.0° |
| N7 | C30 | C31 | H43 | 146.5° | 47.9° |
| C31 | C30 | N7 | H42 | 90.9° | 5.0° |
| C30 | C31 | O12 | H44 | 55.9° | 60.0° |
| C25 | C26 | N6 | H35 | 120.4° | 120.0° |
| C25 | C26 | N6 | H36 | 120.3° | 120.0° |
| C26 | C25 | N5 | H34 | 120.6° | 120.1° |
| C26 | C25 | N5 | H33 | 120.6° | 120.0° |
| C25 | C26 | N6 | C27 | 56.6° | 180.0° |
| C26 | C25 | H34 | H33 | 118.1° | 120.1° |
| C25 | C26 | H35 | H36 | 118.9° | 120.0° |
| C26 | C25 | N5 | H32 | 144.4° | 0.0° |
| C25 | C26 | N6 | H37 | 123.3° | 0.0° |
| N6 | C26 | C25 | N5 | 74.5° | 180.0° |
| C26 | N6 | C27 | C28 | 105.0° | 179.9° |
| C26 | N6 | C27 | H37 | 180.0° | 179.9° |
| C26 | N6 | C27 | O10 | 74.1° | 0.1° |
| N6 | C26 | C25 | H34 | 46.1° | 60.0° |
| N6 | C26 | C25 | H33 | 164.9° | 60.0° |
| N6 | C26 | H35 | H36 | 118.9° | 120.0° |
| N5 | C25 | H34 | H33 | 118.1° | 119.9° |
| N5 | C25 | C26 | H35 | 45.8° | 60.0° |
| N5 | C25 | C26 | H36 | 165.1° | 60.0° |
| O11 | C30 | C31 | H43 | 33.7° | 132.1° |
| O11 | C30 | N7 | H42 | 88.8° | 175.1° |
| C28 | C27 | N6 | O10 | 179.1° | 180.0° |
| C27 | C28 | H39 | H38 | 118.6° | 120.0° |
| C27 | C28 | C29 | H41 | 21.2° | 60.0° |
| C27 | C28 | C29 | H40 | 140.2° | 60.0° |
| C28 | C27 | N6 | H37 | 75.0° | 0.0° |
| C27 | N6 | C26 | H35 | 63.7° | 60.0° |
| C27 | N6 | C26 | H36 | 177.0° | 60.0° |
| N6 | C27 | C28 | H39 | 155.1° | 60.0° |
| N6 | C27 | C28 | H38 | 85.9° | 60.0° |
| O10 | C27 | C28 | H39 | 24.0° | 120.0° |
| O10 | C27 | C28 | H38 | 95.0° | 120.0° |
| O10 | C27 | N6 | H37 | 105.9° | 180.0° |
| H5 | C5 | C6 | H6 | 0.8° | 0.0° |
| H12 | C11 | C10 | H10 | 51.2° | 60.0° |
| H12 | C11 | C10 | H11 | 170.9° | 180.0° |
| H12 | C11 | N4 | H14 | 4.7° | 120.0° |
| H13 | C11 | C10 | H10 | 68.9° | 180.0° |
| H13 | C11 | C10 | H11 | 50.8° | 60.0° |
| H13 | C11 | N4 | H14 | 115.3° | 120.1° |
| H10 | C10 | N3 | H9 | 164.5° | 120.0° |
| H11 | C10 | N3 | H9 | 44.8° | 119.9° |
| H15 | C13 | O3 | H16 | 140.2° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.1° |
| H19 | C15 | H17 | H18 | 120.0° | 119.9° |
| H20 | C16 | H21 | H22 | 120.0° | 120.0° |
| H25 | C18 | C19 | H26 | 0.5° | 0.0° |
| H28 | C21 | C22 | H29 | 104.2° | 72.5° |
| H28 | C21 | C22 | H30 | 137.0° | 167.4° |
| H27 | C21 | C22 | H29 | 14.4° | 47.7° |
| H27 | C21 | C22 | H30 | 104.4° | 72.4° |
| H29 | C22 | C23 | H31 | 104.5° | 78.0° |
| H30 | C22 | C23 | H31 | 136.6° | 161.8° |
| H31 | C23 | C36 | H53 | 49.7° | 114.6° |
| H31 | C23 | C36 | H54 | 168.2° | 126.0° |
| H34 | C25 | C26 | H35 | 166.4° | 60.0° |
| H34 | C25 | C26 | H36 | 74.3° | 180.0° |
| H34 | C25 | N5 | H32 | 23.8° | 120.1° |
| H33 | C25 | C26 | H35 | 74.8° | 180.0° |
| H33 | C25 | C26 | H36 | 44.5° | 60.0° |
| H33 | C25 | N5 | H32 | 95.0° | 120.0° |
| H35 | C26 | N6 | H37 | 116.3° | 119.9° |
| H36 | C26 | N6 | H37 | 3.0° | 120.0° |
| H39 | C28 | C29 | H41 | 99.2° | 180.0° |
| H39 | C28 | C29 | H40 | 19.8° | 60.0° |
| H38 | C28 | C29 | H41 | 141.7° | 60.0° |
| H38 | C28 | C29 | H40 | 99.3° | 180.0° |
| H41 | C29 | N7 | H42 | 111.6° | 120.0° |
| H40 | C29 | N7 | H42 | 7.4° | 119.9° |
| H43 | C31 | O12 | H44 | 62.3° | 180.0° |
| H46 | C33 | H47 | H45 | 120.0° | 120.0° |
| H49 | C34 | H50 | H48 | 120.0° | 120.0° |
| H53 | C36 | C37 | H56 | 158.8° | 44.9° |
| H53 | C36 | C37 | H55 | 40.5° | 74.8° |
| H54 | C36 | C37 | H56 | 40.4° | 164.1° |
| H54 | C36 | C37 | H55 | 77.9° | 44.5° |
| H56 | C37 | C38 | H58 | 119.8° | 73.8° |
| H56 | C37 | C38 | H57 | 122.1° | 46.3° |
| H55 | C37 | C38 | H58 | 1.5° | 166.7° |
| H55 | C37 | C38 | H57 | 119.6° | 73.2° |
| H58 | C38 | C39 | H59 | 50.4° | 75.9° |
| H57 | C38 | C39 | H59 | 67.7° | 44.2° |
| H62 | O14 | P2 | O7 | 125.9° | 60.0° |
| H64 | O5 | P1 | O15 | 114.9° | 60.0° |
