JLS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C18 | sing | 1.53Å | 1.51Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.51Å | |
| C4 | O4 | sing | 1.43Å | 1.43Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| O3 | C3 | sing | 1.43Å | 1.44Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| O2A | C2A | sing | 1.43Å | 1.43Å | |
| CAK | CAJ | sing | 1.53Å | 1.53Å | |
| CAK | CAL | sing | 1.53Å | 1.53Å | |
| C2 | N2 | sing | 1.47Å | 1.46Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| CAI | CAJ | sing | 1.53Å | 1.52Å | |
| CAI | CAH | sing | 1.53Å | 1.52Å | |
| O3A | C3A | sing | 1.43Å | 1.42Å | |
| N2 | CAA | sing | 1.35Å | 1.34Å | |
| C2A | C3A | sing | 1.53Å | 1.53Å | |
| C2A | C1A | sing | 1.53Å | 1.53Å | |
| O1A | C1 | sing | 1.43Å | 1.42Å | |
| O1A | C1A | sing | 1.43Å | 1.43Å | |
| CAF | CAG | sing | 1.53Å | 1.52Å | |
| CAF | CAE | sing | 1.53Å | 1.52Å | |
| CAC | CAD | sing | 1.53Å | 1.52Å | |
| CAC | CAB | sing | 1.53Å | 1.52Å | |
| CAD | CAE | sing | 1.53Å | 1.52Å | |
| CAL | CAM | sing | 1.53Å | 1.53Å | |
| C3A | C4A | sing | 1.53Å | 1.53Å | |
| C1A | O5A | sing | 1.43Å | 1.44Å | |
| CAA | CAB | sing | 1.51Å | 1.51Å | |
| CAA | OAA | doub | 1.21Å | 1.22Å | |
| CAH | CAG | sing | 1.53Å | 1.52Å | |
| CAM | CAN | sing | 1.53Å | 1.53Å | |
| C4A | O4A | sing | 1.43Å | 1.43Å | |
| C4A | C5M | sing | 1.53Å | 1.53Å | |
| O5A | C5M | sing | 1.43Å | 1.44Å | |
| CAN | CAO | sing | 1.51Å | 1.52Å | |
| C5M | C6A | sing | 1.53Å | 1.53Å | |
| CAX | CAW | sing | 1.53Å | 1.51Å | |
| CAO | CAP | doub | 1.31Å | 1.34Å | |
| CAW | CAV | sing | 1.53Å | 1.54Å | |
| C6A | O6A | sing | 1.43Å | 1.43Å | |
| CAP | CAQ | sing | 1.51Å | 1.52Å | |
| CAV | CAU | sing | 1.53Å | 1.54Å | |
| CAQ | CAR | sing | 1.53Å | 1.52Å | |
| CAR | CAS | sing | 1.53Å | 1.53Å | |
| CAT | CAU | sing | 1.53Å | 1.54Å | |
| CAT | CAS | sing | 1.53Å | 1.52Å | |
| CAB | H1 | sing | 1.09Å | 1.10Å | |
| CAB | H2 | sing | 1.09Å | 1.10Å | |
| CAC | H3 | sing | 1.09Å | 1.10Å | |
| CAC | H4 | sing | 1.09Å | 1.10Å | |
| CAD | H5 | sing | 1.09Å | 1.10Å | |
| CAD | H6 | sing | 1.09Å | 1.10Å | |
| CAE | H7 | sing | 1.09Å | 1.10Å | |
| CAE | H8 | sing | 1.09Å | 1.10Å | |
| CAF | H9 | sing | 1.09Å | 1.10Å | |
| CAF | H10 | sing | 1.09Å | 1.10Å | |
| CAG | H11 | sing | 1.09Å | 1.10Å | |
| CAG | H12 | sing | 1.09Å | 1.10Å | |
| CAH | H13 | sing | 1.09Å | 1.10Å | |
| CAH | H14 | sing | 1.09Å | 1.10Å | |
| CAI | H15 | sing | 1.09Å | 1.10Å | |
| CAI | H16 | sing | 1.09Å | 1.10Å | |
| CAJ | H17 | sing | 1.09Å | 1.10Å | |
| CAJ | H18 | sing | 1.09Å | 1.10Å | |
| CAK | H19 | sing | 1.09Å | 1.10Å | |
| CAK | H20 | sing | 1.09Å | 1.10Å | |
| CAL | H21 | sing | 1.09Å | 1.10Å | |
| CAL | H22 | sing | 1.09Å | 1.10Å | |
| CAM | H23 | sing | 1.09Å | 1.10Å | |
| CAM | H24 | sing | 1.09Å | 1.10Å | |
| CAN | H25 | sing | 1.09Å | 1.10Å | |
| CAN | H26 | sing | 1.09Å | 1.10Å | |
| CAO | H27 | sing | 1.08Å | 1.08Å | |
| CAP | H28 | sing | 1.08Å | 1.08Å | |
| CAQ | H29 | sing | 1.09Å | 1.10Å | |
| CAQ | H30 | sing | 1.09Å | 1.10Å | |
| CAR | H31 | sing | 1.09Å | 1.10Å | |
| CAR | H32 | sing | 1.09Å | 1.10Å | |
| CAS | H33 | sing | 1.09Å | 1.10Å | |
| CAS | H34 | sing | 1.09Å | 1.10Å | |
| CAT | H35 | sing | 1.09Å | 1.10Å | |
| CAT | H36 | sing | 1.09Å | 1.10Å | |
| CAU | H37 | sing | 1.09Å | 1.10Å | |
| CAU | H38 | sing | 1.09Å | 1.10Å | |
| CAV | H39 | sing | 1.09Å | 1.10Å | |
| CAV | H40 | sing | 1.09Å | 1.10Å | |
| CAW | H41 | sing | 1.09Å | 1.10Å | |
| CAW | H42 | sing | 1.09Å | 1.10Å | |
| CAX | H43 | sing | 1.09Å | 1.10Å | |
| CAX | H44 | sing | 1.09Å | 1.10Å | |
| CAX | H45 | sing | 1.09Å | 1.10Å | |
| C1 | H46 | sing | 1.09Å | 1.10Å | |
| C1 | H47 | sing | 1.09Å | 1.10Å | |
| C1A | H48 | sing | 1.09Å | 1.10Å | |
| C2 | H49 | sing | 1.09Å | 1.10Å | |
| C2A | H50 | sing | 1.09Å | 1.10Å | |
| N2 | H51 | sing | 0.97Å | 1.00Å | |
| O2A | H52 | sing | 0.97Å | 0.95Å | |
| C3 | H53 | sing | 1.09Å | 1.10Å | |
| C3A | H54 | sing | 1.09Å | 1.10Å | |
| O3 | H55 | sing | 0.97Å | 0.95Å | |
| O3A | H56 | sing | 0.97Å | 0.95Å | |
| C4 | H57 | sing | 1.09Å | 1.10Å | |
| C4A | H58 | sing | 1.09Å | 1.10Å | |
| O4 | H59 | sing | 0.97Å | 0.95Å | |
| O4A | H60 | sing | 0.97Å | 0.95Å | |
| C5 | H61 | sing | 1.09Å | 1.10Å | |
| C5 | H62 | sing | 1.09Å | 1.10Å | |
| C5M | H63 | sing | 1.09Å | 1.10Å | |
| O6A | H64 | sing | 0.97Å | 0.95Å | |
| C6 | H65 | sing | 1.09Å | 1.10Å | |
| C6 | H66 | sing | 1.09Å | 1.10Å | |
| C6A | H67 | sing | 1.09Å | 1.10Å | |
| C6A | H68 | sing | 1.09Å | 1.10Å | |
| C7 | H69 | sing | 1.09Å | 1.10Å | |
| C7 | H70 | sing | 1.09Å | 1.10Å | |
| C8 | H71 | sing | 1.09Å | 1.10Å | |
| C8 | H72 | sing | 1.09Å | 1.10Å | |
| C9 | H73 | sing | 1.09Å | 1.10Å | |
| C9 | H74 | sing | 1.09Å | 1.10Å | |
| C10 | H75 | sing | 1.09Å | 1.10Å | |
| C10 | H76 | sing | 1.09Å | 1.10Å | |
| C11 | H77 | sing | 1.09Å | 1.10Å | |
| C11 | H78 | sing | 1.09Å | 1.10Å | |
| C12 | H79 | sing | 1.09Å | 1.10Å | |
| C12 | H80 | sing | 1.09Å | 1.10Å | |
| C13 | H81 | sing | 1.09Å | 1.10Å | |
| C13 | H82 | sing | 1.09Å | 1.10Å | |
| C14 | H83 | sing | 1.09Å | 1.10Å | |
| C14 | H84 | sing | 1.09Å | 1.10Å | |
| C15 | H85 | sing | 1.09Å | 1.10Å | |
| C15 | H86 | sing | 1.09Å | 1.10Å | |
| C16 | H87 | sing | 1.09Å | 1.10Å | |
| C16 | H88 | sing | 1.09Å | 1.10Å | |
| C17 | H89 | sing | 1.09Å | 1.10Å | |
| C17 | H90 | sing | 1.09Å | 1.10Å | |
| C18 | H91 | sing | 1.09Å | 1.10Å | |
| C18 | H92 | sing | 1.09Å | 1.10Å | |
| C18 | H93 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | C16 | 110.5° | 109.4° |
| C18 | C17 | H89 | 109.2° | 109.5° |
| C18 | C17 | H90 | 109.2° | 109.4° |
| C17 | C18 | H91 | 109.5° | 109.5° |
| C17 | C18 | H92 | 109.5° | 109.5° |
| C17 | C18 | H93 | 109.5° | 109.5° |
| C17 | C16 | C15 | 110.9° | 109.4° |
| C17 | C16 | H87 | 109.1° | 109.5° |
| C17 | C16 | H88 | 109.1° | 109.5° |
| C16 | C17 | H89 | 109.2° | 109.5° |
| C16 | C17 | H90 | 109.2° | 109.5° |
| C16 | C15 | C14 | 110.7° | 109.5° |
| C16 | C15 | H85 | 109.2° | 109.5° |
| C16 | C15 | H86 | 109.2° | 109.4° |
| C15 | C16 | H87 | 109.1° | 109.5° |
| C15 | C16 | H88 | 109.1° | 109.5° |
| C15 | C14 | C13 | 110.0° | 109.5° |
| C15 | C14 | H83 | 109.3° | 109.5° |
| C15 | C14 | H84 | 109.3° | 109.5° |
| C14 | C15 | H85 | 109.2° | 109.5° |
| C14 | C15 | H86 | 109.2° | 109.5° |
| C14 | C13 | C12 | 111.5° | 109.5° |
| C14 | C13 | H81 | 109.0° | 109.4° |
| C14 | C13 | H82 | 109.0° | 109.5° |
| C13 | C14 | H83 | 109.3° | 109.4° |
| C13 | C14 | H84 | 109.4° | 109.5° |
| C13 | C12 | C11 | 109.1° | 109.5° |
| C13 | C12 | H79 | 109.6° | 109.4° |
| C13 | C12 | H80 | 109.6° | 109.4° |
| C12 | C13 | H81 | 109.0° | 109.4° |
| C12 | C13 | H82 | 109.0° | 109.4° |
| C12 | C11 | C10 | 111.5° | 109.5° |
| C12 | C11 | H77 | 108.9° | 109.5° |
| C12 | C11 | H78 | 109.0° | 109.5° |
| C11 | C12 | H79 | 109.6° | 109.5° |
| C11 | C12 | H80 | 109.5° | 109.5° |
| C11 | C10 | C9 | 110.4° | 109.5° |
| C11 | C10 | H75 | 109.2° | 109.4° |
| C11 | C10 | H76 | 109.2° | 109.4° |
| C10 | C11 | H77 | 109.0° | 109.4° |
| C10 | C11 | H78 | 109.0° | 109.5° |
| C10 | C9 | C8 | 108.9° | 109.4° |
| C10 | C9 | H73 | 109.6° | 109.5° |
| C10 | C9 | H74 | 109.6° | 109.5° |
| C9 | C10 | H75 | 109.2° | 109.5° |
| C9 | C10 | H76 | 109.2° | 109.5° |
| C9 | C8 | C7 | 111.9° | 109.4° |
| C9 | C8 | H71 | 108.9° | 109.5° |
| C9 | C8 | H72 | 108.9° | 109.4° |
| C8 | C9 | H73 | 109.6° | 109.5° |
| C8 | C9 | H74 | 109.6° | 109.5° |
| C8 | C7 | C6 | 109.3° | 109.5° |
| C8 | C7 | H69 | 109.5° | 109.5° |
| C8 | C7 | H70 | 109.5° | 109.5° |
| C7 | C8 | H71 | 108.9° | 109.5° |
| C7 | C8 | H72 | 108.9° | 109.5° |
| C7 | C6 | C5 | 111.1° | 109.5° |
| C7 | C6 | H65 | 109.1° | 109.5° |
| C7 | C6 | H66 | 109.1° | 109.5° |
| C6 | C7 | H69 | 109.5° | 109.5° |
| C6 | C7 | H70 | 109.5° | 109.5° |
| C6 | C5 | C4 | 110.5° | 109.5° |
| C6 | C5 | H61 | 109.2° | 109.4° |
| C6 | C5 | H62 | 109.2° | 109.4° |
| C5 | C6 | H65 | 109.1° | 109.4° |
| C5 | C6 | H66 | 109.1° | 109.4° |
| C5 | C4 | O4 | 109.5° | 109.5° |
| C5 | C4 | C3 | 116.7° | 109.5° |
| C5 | C4 | H57 | 104.8° | 109.5° |
| C4 | C5 | H61 | 109.2° | 109.5° |
| C4 | C5 | H62 | 109.2° | 109.5° |
| O4 | C4 | C3 | 114.4° | 109.5° |
| O4 | C4 | H57 | 105.6° | 109.5° |
| C4 | O4 | H59 | 109.5° | 114.0° |
| C4 | C3 | O3 | 105.1° | 109.5° |
| C4 | C3 | C2 | 116.1° | 109.5° |
| C4 | C3 | H53 | 108.8° | 109.5° |
| C3 | C4 | H57 | 104.5° | 109.5° |
| O3 | C3 | C2 | 108.1° | 109.5° |
| O3 | C3 | H53 | 110.1° | 109.5° |
| C3 | O3 | H55 | 109.5° | 114.0° |
| C3 | C2 | N2 | 110.8° | 109.5° |
| C3 | C2 | C1 | 115.8° | 109.5° |
| C3 | C2 | H49 | 106.7° | 109.5° |
| C2 | C3 | H53 | 108.6° | 109.5° |
| O2A | C2A | C3A | 111.6° | 109.5° |
| O2A | C2A | C1A | 111.2° | 109.6° |
| O2A | C2A | H50 | 108.8° | 109.6° |
| C2A | O2A | H52 | 109.5° | 114.0° |
| CAJ | CAK | CAL | 111.8° | 109.5° |
| CAK | CAJ | CAI | 111.5° | 109.5° |
| CAK | CAJ | H17 | 109.0° | 109.5° |
| CAK | CAJ | H18 | 108.9° | 109.5° |
| CAJ | CAK | H19 | 108.9° | 109.5° |
| CAJ | CAK | H20 | 108.9° | 109.4° |
| CAK | CAL | CAM | 112.7° | 109.5° |
| CAL | CAK | H19 | 108.9° | 109.5° |
| CAL | CAK | H20 | 108.9° | 109.5° |
| CAK | CAL | H21 | 108.7° | 109.4° |
| CAK | CAL | H22 | 108.6° | 109.5° |
| N2 | C2 | C1 | 108.6° | 109.4° |
| C2 | N2 | CAA | 122.3° | 120.1° |
| N2 | C2 | H49 | 107.7° | 109.5° |
| C2 | N2 | H51 | 118.9° | 120.0° |
| C2 | C1 | O1A | 110.8° | 109.5° |
| C2 | C1 | H46 | 109.1° | 109.4° |
| C2 | C1 | H47 | 109.2° | 109.4° |
| C1 | C2 | H49 | 106.9° | 109.5° |
| CAJ | CAI | CAH | 110.4° | 109.5° |
| CAJ | CAI | H15 | 109.3° | 109.4° |
| CAJ | CAI | H16 | 109.3° | 109.4° |
| CAI | CAJ | H17 | 109.0° | 109.4° |
| CAI | CAJ | H18 | 109.0° | 109.4° |
| CAI | CAH | CAG | 111.8° | 109.5° |
| CAI | CAH | H13 | 108.9° | 109.4° |
| CAI | CAH | H14 | 108.9° | 109.5° |
| CAH | CAI | H15 | 109.3° | 109.5° |
| CAH | CAI | H16 | 109.2° | 109.5° |
| O3A | C3A | C2A | 111.5° | 109.6° |
| O3A | C3A | C4A | 110.8° | 109.6° |
| O3A | C3A | H54 | 108.6° | 109.6° |
| C3A | O3A | H56 | 109.5° | 114.0° |
| N2 | CAA | CAB | 118.9° | 120.0° |
| N2 | CAA | OAA | 123.2° | 120.0° |
| CAA | N2 | H51 | 118.9° | 120.0° |
| C3A | C2A | C1A | 109.8° | 109.2° |
| C2A | C3A | C4A | 111.2° | 109.0° |
| C3A | C2A | H50 | 107.6° | 109.5° |
| C2A | C3A | H54 | 107.3° | 109.5° |
| C2A | C1A | O1A | 110.6° | 109.4° |
| C2A | C1A | O5A | 108.8° | 109.4° |
| C2A | C1A | H48 | 107.5° | 109.5° |
| C1A | C2A | H50 | 107.6° | 109.5° |
| C1 | O1A | C1A | 115.7° | 114.0° |
| O1A | C1 | H46 | 109.1° | 109.5° |
| O1A | C1 | H47 | 109.1° | 109.5° |
| O1A | C1A | O5A | 112.3° | 109.5° |
| O1A | C1A | H48 | 108.8° | 109.4° |
| CAG | CAF | CAE | 109.1° | 109.4° |
| CAF | CAG | CAH | 111.0° | 109.4° |
| CAG | CAF | H9 | 109.6° | 109.5° |
| CAG | CAF | H10 | 109.6° | 109.4° |
| CAF | CAG | H11 | 109.1° | 109.5° |
| CAF | CAG | H12 | 109.1° | 109.5° |
| CAF | CAE | CAD | 113.9° | 109.5° |
| CAF | CAE | H7 | 108.4° | 109.4° |
| CAF | CAE | H8 | 108.4° | 109.5° |
| CAE | CAF | H9 | 109.6° | 109.5° |
| CAE | CAF | H10 | 109.6° | 109.5° |
| CAD | CAC | CAB | 112.6° | 109.5° |
| CAC | CAD | CAE | 110.1° | 109.5° |
| CAD | CAC | H3 | 108.7° | 109.4° |
| CAD | CAC | H4 | 108.7° | 109.4° |
| CAC | CAD | H5 | 109.3° | 109.5° |
| CAC | CAD | H6 | 109.3° | 109.5° |
| CAC | CAB | CAA | 105.4° | 109.5° |
| CAC | CAB | H1 | 110.5° | 109.5° |
| CAC | CAB | H2 | 110.5° | 109.4° |
| CAB | CAC | H3 | 108.7° | 109.5° |
| CAB | CAC | H4 | 108.7° | 109.5° |
| CAE | CAD | H5 | 109.3° | 109.4° |
| CAE | CAD | H6 | 109.3° | 109.5° |
| CAD | CAE | H7 | 108.3° | 109.5° |
| CAD | CAE | H8 | 108.4° | 109.5° |
| CAL | CAM | CAN | 110.8° | 109.5° |
| CAM | CAL | H21 | 108.6° | 109.5° |
| CAM | CAL | H22 | 108.7° | 109.5° |
| CAL | CAM | H23 | 109.1° | 109.4° |
| CAL | CAM | H24 | 109.1° | 109.5° |
| C3A | C4A | O4A | 111.7° | 109.5° |
| C3A | C4A | C5M | 107.8° | 109.2° |
| C4A | C3A | H54 | 107.2° | 109.5° |
| C3A | C4A | H58 | 108.5° | 109.5° |
| C1A | O5A | C5M | 117.9° | 114.1° |
| O5A | C1A | H48 | 108.7° | 109.5° |
| CAB | CAA | OAA | 117.9° | 120.0° |
| CAA | CAB | H1 | 110.5° | 109.5° |
| CAA | CAB | H2 | 110.5° | 109.5° |
| CAH | CAG | H11 | 109.1° | 109.4° |
| CAH | CAG | H12 | 109.1° | 109.4° |
| CAG | CAH | H13 | 108.9° | 109.5° |
| CAG | CAH | H14 | 108.9° | 109.5° |
| CAM | CAN | CAO | 111.1° | 109.4° |
| CAN | CAM | H23 | 109.1° | 109.5° |
| CAN | CAM | H24 | 109.1° | 109.5° |
| CAM | CAN | H25 | 109.1° | 109.4° |
| CAM | CAN | H26 | 109.1° | 109.4° |
| O4A | C4A | C5M | 110.4° | 109.6° |
| O4A | C4A | H58 | 109.9° | 109.5° |
| C4A | O4A | H60 | 109.5° | 114.0° |
| C4A | C5M | O5A | 111.6° | 109.4° |
| C4A | C5M | C6A | 113.9° | 109.5° |
| C5M | C4A | H58 | 108.5° | 109.5° |
| C4A | C5M | H63 | 105.9° | 109.5° |
| O5A | C5M | C6A | 111.9° | 109.5° |
| O5A | C5M | H63 | 106.9° | 109.5° |
| CAN | CAO | CAP | 123.8° | 120.0° |
| CAO | CAN | H25 | 109.1° | 109.5° |
| CAO | CAN | H26 | 109.1° | 109.5° |
| CAN | CAO | H27 | 118.1° | 120.0° |
| C5M | C6A | O6A | 108.3° | 109.5° |
| C6A | C5M | H63 | 105.9° | 109.5° |
| C5M | C6A | H67 | 109.8° | 109.5° |
| C5M | C6A | H68 | 109.7° | 109.5° |
| CAX | CAW | CAV | 114.4° | 109.5° |
| CAX | CAW | H41 | 108.2° | 109.5° |
| CAX | CAW | H42 | 108.3° | 109.4° |
| CAW | CAX | H43 | 109.5° | 109.5° |
| CAW | CAX | H44 | 109.5° | 109.5° |
| CAW | CAX | H45 | 109.5° | 109.4° |
| CAO | CAP | CAQ | 124.0° | 120.0° |
| CAP | CAO | H27 | 118.1° | 120.0° |
| CAO | CAP | H28 | 118.0° | 120.0° |
| CAW | CAV | CAU | 114.3° | 109.5° |
| CAW | CAV | H39 | 108.3° | 109.5° |
| CAW | CAV | H40 | 108.2° | 109.4° |
| CAV | CAW | H41 | 108.2° | 109.5° |
| CAV | CAW | H42 | 108.2° | 109.4° |
| C6A | O6A | H64 | 109.5° | 114.0° |
| O6A | C6A | H67 | 109.8° | 109.5° |
| O6A | C6A | H68 | 109.8° | 109.4° |
| CAP | CAQ | CAR | 111.3° | 109.5° |
| CAQ | CAP | H28 | 118.0° | 120.0° |
| CAP | CAQ | H29 | 109.0° | 109.5° |
| CAP | CAQ | H30 | 109.0° | 109.5° |
| CAV | CAU | CAT | 115.2° | 109.5° |
| CAV | CAU | H37 | 108.0° | 109.4° |
| CAV | CAU | H38 | 108.0° | 109.4° |
| CAU | CAV | H39 | 108.3° | 109.5° |
| CAU | CAV | H40 | 108.3° | 109.4° |
| CAQ | CAR | CAS | 110.9° | 109.5° |
| CAR | CAQ | H29 | 109.0° | 109.4° |
| CAR | CAQ | H30 | 109.0° | 109.4° |
| CAQ | CAR | H31 | 109.1° | 109.5° |
| CAQ | CAR | H32 | 109.1° | 109.4° |
| CAR | CAS | CAT | 110.6° | 109.5° |
| CAS | CAR | H31 | 109.1° | 109.5° |
| CAS | CAR | H32 | 109.1° | 109.4° |
| CAR | CAS | H33 | 109.2° | 109.5° |
| CAR | CAS | H34 | 109.2° | 109.4° |
| CAU | CAT | CAS | 112.9° | 109.5° |
| CAU | CAT | H35 | 108.6° | 109.5° |
| CAU | CAT | H36 | 108.6° | 109.5° |
| CAT | CAU | H37 | 108.0° | 109.5° |
| CAT | CAU | H38 | 108.0° | 109.5° |
| CAT | CAS | H33 | 109.2° | 109.4° |
| CAT | CAS | H34 | 109.2° | 109.4° |
| CAS | CAT | H35 | 108.6° | 109.5° |
| CAS | CAT | H36 | 108.6° | 109.4° |
| H1 | CAB | H2 | 109.4° | 109.5° |
| H3 | CAC | H4 | 109.5° | 109.5° |
| H5 | CAD | H6 | 109.5° | 109.5° |
| H7 | CAE | H8 | 109.5° | 109.4° |
| H9 | CAF | H10 | 109.5° | 109.5° |
| H11 | CAG | H12 | 109.5° | 109.5° |
| H13 | CAH | H14 | 109.4° | 109.4° |
| H15 | CAI | H16 | 109.4° | 109.5° |
| H17 | CAJ | H18 | 109.4° | 109.5° |
| H19 | CAK | H20 | 109.5° | 109.4° |
| H21 | CAL | H22 | 109.5° | 109.5° |
| H23 | CAM | H24 | 109.5° | 109.4° |
| H25 | CAN | H26 | 109.4° | 109.5° |
| H29 | CAQ | H30 | 109.4° | 109.5° |
| H31 | CAR | H32 | 109.5° | 109.5° |
| H33 | CAS | H34 | 109.5° | 109.5° |
| H35 | CAT | H36 | 109.5° | 109.5° |
| H37 | CAU | H38 | 109.4° | 109.5° |
| H39 | CAV | H40 | 109.5° | 109.5° |
| H41 | CAW | H42 | 109.5° | 109.5° |
| H43 | CAX | H44 | 109.4° | 109.5° |
| H43 | CAX | H45 | 109.5° | 109.5° |
| H44 | CAX | H45 | 109.5° | 109.5° |
| H46 | C1 | H47 | 109.5° | 109.5° |
| H61 | C5 | H62 | 109.5° | 109.5° |
| H65 | C6 | H66 | 109.5° | 109.4° |
| H67 | C6A | H68 | 109.5° | 109.5° |
| H69 | C7 | H70 | 109.5° | 109.5° |
| H71 | C8 | H72 | 109.4° | 109.5° |
| H73 | C9 | H74 | 109.5° | 109.5° |
| H75 | C10 | H76 | 109.5° | 109.5° |
| H77 | C11 | H78 | 109.5° | 109.4° |
| H79 | C12 | H80 | 109.5° | 109.4° |
| H81 | C13 | H82 | 109.5° | 109.5° |
| H83 | C14 | H84 | 109.5° | 109.5° |
| H85 | C15 | H86 | 109.5° | 109.5° |
| H87 | C16 | H88 | 109.5° | 109.5° |
| H89 | C17 | H90 | 109.5° | 109.5° |
| H91 | C18 | H92 | 109.4° | 109.5° |
| H91 | C18 | H93 | 109.5° | 109.5° |
| H92 | C18 | H93 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | C16 | H89 | 120.2° | 120.0° |
| C18 | C17 | C16 | H90 | 120.1° | 120.0° |
| C18 | C17 | C16 | C15 | 117.6° | 180.0° |
| C18 | C17 | C16 | H87 | 2.6° | 60.0° |
| C18 | C17 | C16 | H88 | 122.2° | 60.0° |
| C18 | C17 | H89 | H90 | 119.5° | 120.0° |
| C17 | C18 | H91 | H92 | 120.0° | 120.0° |
| C17 | C18 | H91 | H93 | 120.0° | 120.0° |
| C17 | C18 | H92 | H93 | 120.0° | 120.0° |
| C17 | C16 | C15 | H87 | 120.2° | 120.0° |
| C17 | C16 | C15 | H88 | 120.2° | 120.0° |
| C17 | C16 | C15 | C14 | 148.8° | 180.0° |
| C17 | C16 | C15 | H85 | 28.7° | 60.0° |
| C17 | C16 | C15 | H86 | 91.0° | 60.0° |
| C17 | C16 | H87 | H88 | 119.4° | 120.0° |
| C16 | C17 | H89 | H90 | 119.5° | 120.0° |
| C16 | C17 | C18 | H91 | 180.0° | 180.0° |
| C16 | C17 | C18 | H92 | 60.0° | 60.0° |
| C16 | C17 | C18 | H93 | 60.0° | 60.0° |
| C16 | C15 | C14 | H85 | 120.2° | 120.0° |
| C16 | C15 | C14 | H86 | 120.2° | 120.0° |
| C16 | C15 | C14 | C13 | 178.7° | 179.9° |
| C16 | C15 | C14 | H83 | 61.2° | 60.0° |
| C16 | C15 | C14 | H84 | 58.6° | 60.0° |
| C16 | C15 | H85 | H86 | 119.5° | 120.0° |
| C15 | C16 | H87 | H88 | 119.3° | 120.0° |
| C15 | C16 | C17 | H89 | 122.2° | 60.0° |
| C15 | C16 | C17 | H90 | 2.5° | 60.0° |
| C15 | C14 | C13 | H83 | 120.1° | 120.0° |
| C15 | C14 | C13 | H84 | 120.1° | 120.1° |
| C15 | C14 | C13 | C12 | 109.7° | 180.0° |
| C15 | C14 | C13 | H81 | 130.0° | 60.1° |
| C15 | C14 | C13 | H82 | 10.6° | 60.0° |
| C15 | C14 | H83 | H84 | 119.8° | 120.1° |
| C14 | C15 | H85 | H86 | 119.5° | 120.0° |
| C14 | C15 | C16 | H87 | 91.0° | 60.0° |
| C14 | C15 | C16 | H88 | 28.6° | 60.0° |
| C14 | C13 | C12 | H81 | 120.3° | 119.9° |
| C14 | C13 | C12 | H82 | 120.3° | 120.1° |
| C14 | C13 | C12 | C11 | 127.3° | 180.0° |
| C14 | C13 | C12 | H79 | 112.7° | 60.0° |
| C14 | C13 | C12 | H80 | 7.4° | 59.9° |
| C14 | C13 | H81 | H82 | 119.1° | 120.1° |
| C13 | C14 | H83 | H84 | 119.8° | 120.0° |
| C13 | C14 | C15 | H85 | 58.6° | 60.1° |
| C13 | C14 | C15 | H86 | 61.1° | 60.0° |
| C13 | C12 | C11 | H79 | 120.0° | 120.0° |
| C13 | C12 | C11 | H80 | 119.9° | 120.0° |
| C13 | C12 | C11 | C10 | 147.4° | 180.0° |
| C13 | C12 | C11 | H77 | 92.4° | 60.0° |
| C13 | C12 | C11 | H78 | 27.0° | 59.9° |
| C13 | C12 | H79 | H80 | 120.2° | 119.9° |
| C12 | C13 | H81 | H82 | 119.1° | 119.9° |
| C12 | C13 | C14 | H83 | 10.4° | 60.1° |
| C12 | C13 | C14 | H84 | 130.2° | 59.9° |
| C12 | C11 | C10 | H77 | 120.3° | 120.0° |
| C12 | C11 | C10 | H78 | 120.3° | 120.1° |
| C12 | C11 | C10 | C9 | 117.6° | 180.0° |
| C12 | C11 | C10 | H75 | 2.5° | 60.0° |
| C12 | C11 | C10 | H76 | 122.2° | 59.9° |
| C12 | C11 | H77 | H78 | 119.1° | 120.0° |
| C11 | C12 | H79 | H80 | 120.1° | 120.0° |
| C11 | C12 | C13 | H81 | 7.0° | 60.0° |
| C11 | C12 | C13 | H82 | 112.4° | 59.9° |
| C11 | C10 | C9 | H75 | 120.1° | 120.0° |
| C11 | C10 | C9 | H76 | 120.1° | 120.0° |
| C11 | C10 | C9 | C8 | 159.4° | 180.0° |
| C11 | C10 | C9 | H73 | 80.6° | 60.0° |
| C11 | C10 | C9 | H74 | 39.5° | 60.0° |
| C11 | C10 | H75 | H76 | 119.6° | 119.9° |
| C10 | C11 | H77 | H78 | 119.1° | 120.0° |
| C10 | C11 | C12 | H79 | 27.4° | 60.0° |
| C10 | C11 | C12 | H80 | 92.7° | 60.0° |
| C10 | C9 | C8 | H73 | 119.9° | 120.0° |
| C10 | C9 | C8 | H74 | 119.9° | 120.0° |
| C10 | C9 | C8 | C7 | 159.5° | 180.0° |
| C10 | C9 | C8 | H71 | 80.1° | 60.0° |
| C10 | C9 | C8 | H72 | 39.1° | 60.0° |
| C10 | C9 | H73 | H74 | 120.2° | 120.0° |
| C9 | C10 | H75 | H76 | 119.6° | 120.1° |
| C9 | C10 | C11 | H77 | 122.1° | 60.0° |
| C9 | C10 | C11 | H78 | 2.7° | 59.9° |
| C9 | C8 | C7 | H71 | 120.4° | 120.0° |
| C9 | C8 | C7 | H72 | 120.4° | 120.0° |
| C9 | C8 | C7 | C6 | 103.4° | 180.0° |
| C9 | C8 | C7 | H69 | 136.6° | 60.0° |
| C9 | C8 | C7 | H70 | 16.5° | 60.0° |
| C9 | C8 | H71 | H72 | 118.9° | 120.0° |
| C8 | C9 | H73 | H74 | 120.3° | 120.0° |
| C8 | C9 | C10 | H75 | 39.3° | 60.0° |
| C8 | C9 | C10 | H76 | 80.4° | 60.0° |
| C8 | C7 | C6 | H69 | 120.0° | 120.0° |
| C8 | C7 | C6 | H70 | 120.0° | 120.0° |
| C8 | C7 | C6 | C5 | 113.5° | 180.0° |
| C8 | C7 | C6 | H65 | 6.7° | 60.0° |
| C8 | C7 | C6 | H66 | 126.2° | 60.0° |
| C8 | C7 | H69 | H70 | 120.1° | 120.0° |
| C7 | C8 | H71 | H72 | 118.9° | 120.0° |
| C7 | C8 | C9 | H73 | 39.6° | 60.0° |
| C7 | C8 | C9 | H74 | 80.6° | 60.0° |
| C7 | C6 | C5 | H65 | 120.2° | 120.0° |
| C7 | C6 | C5 | H66 | 120.3° | 120.1° |
| C7 | C6 | C5 | C4 | 166.4° | 180.0° |
| C7 | C6 | C5 | H61 | 73.4° | 60.0° |
| C7 | C6 | C5 | H62 | 46.3° | 60.0° |
| C7 | C6 | H65 | H66 | 119.3° | 120.1° |
| C6 | C7 | H69 | H70 | 120.1° | 120.0° |
| C6 | C7 | C8 | H71 | 16.9° | 60.0° |
| C6 | C7 | C8 | H72 | 136.2° | 60.0° |
| C6 | C5 | C4 | H61 | 120.1° | 120.0° |
| C6 | C5 | C4 | H62 | 120.2° | 120.0° |
| C6 | C5 | C4 | O4 | 3.6° | 65.0° |
| C6 | C5 | C4 | C3 | 128.5° | 175.0° |
| C6 | C5 | C4 | H57 | 116.5° | 55.0° |
| C6 | C5 | H61 | H62 | 119.5° | 120.0° |
| C5 | C6 | H65 | H66 | 119.3° | 119.9° |
| C5 | C6 | C7 | H69 | 126.5° | 60.0° |
| C5 | C6 | C7 | H70 | 6.5° | 60.0° |
| C5 | C4 | O4 | C3 | 133.3° | 120.0° |
| C5 | C4 | O4 | H57 | 112.3° | 120.0° |
| C5 | C4 | C3 | H57 | 115.2° | 120.0° |
| C5 | C4 | C3 | O3 | 150.7° | 60.0° |
| C5 | C4 | C3 | C2 | 90.0° | NaN° |
| C5 | C4 | C3 | H53 | 32.8° | 60.0° |
| C5 | C4 | O4 | H59 | 180.0° | 60.0° |
| C4 | C5 | H61 | H62 | 119.5° | 120.0° |
| C4 | C5 | C6 | H65 | 46.2° | 60.0° |
| C4 | C5 | C6 | H66 | 73.3° | 59.9° |
| O4 | C4 | C3 | H57 | 115.0° | 120.0° |
| O4 | C4 | C3 | O3 | 79.5° | 180.0° |
| O4 | C4 | C3 | C2 | 39.9° | 60.0° |
| O4 | C4 | C3 | H53 | 162.7° | 60.0° |
| O4 | C4 | C5 | H61 | 123.7° | 175.0° |
| O4 | C4 | C5 | H62 | 116.6° | 55.0° |
| C4 | C3 | O3 | C2 | 124.5° | 120.0° |
| C4 | C3 | O3 | H53 | 116.9° | 120.0° |
| C4 | C3 | C2 | H53 | 122.9° | 120.0° |
| C4 | C3 | C2 | N2 | 81.6° | 65.7° |
| C4 | C3 | C2 | C1 | 154.1° | 174.3° |
| C4 | C3 | C2 | H49 | 35.3° | 54.3° |
| C4 | C3 | O3 | H55 | 180.0° | 64.9° |
| C3 | C4 | O4 | H59 | 46.8° | 60.0° |
| C3 | C4 | C5 | H61 | 8.4° | 55.0° |
| C3 | C4 | C5 | H62 | 111.3° | 65.0° |
| O3 | C3 | C2 | H53 | 119.4° | 120.0° |
| O3 | C3 | C2 | N2 | 160.7° | 174.3° |
| O3 | C3 | C2 | C1 | 36.4° | 54.3° |
| O3 | C3 | C2 | H49 | 82.4° | 65.7° |
| O3 | C3 | C4 | H57 | 35.5° | 60.0° |
| C3 | C2 | N2 | C1 | 128.2° | 120.0° |
| C3 | C2 | N2 | H49 | 116.3° | 120.0° |
| C3 | C2 | C1 | H49 | 118.7° | 120.0° |
| C3 | C2 | N2 | CAA | 143.0° | 155.0° |
| C3 | C2 | C1 | O1A | 54.8° | 54.5° |
| C3 | C2 | C1 | H46 | 65.4° | 174.5° |
| C3 | C2 | C1 | H47 | 175.0° | 65.6° |
| C3 | C2 | N2 | H51 | 37.0° | 25.0° |
| C2 | C3 | O3 | H55 | 55.5° | 55.1° |
| C2 | C3 | C4 | H57 | 154.9° | 60.0° |
| O2A | C2A | C3A | O3A | 53.1° | 63.2° |
| O2A | C2A | C3A | C1A | 123.8° | 120.0° |
| O2A | C2A | C3A | H50 | 119.4° | 120.2° |
| O2A | C2A | C1A | H50 | 119.1° | 120.2° |
| O2A | C2A | C1A | O1A | 54.5° | 57.5° |
| O2A | C2A | C3A | C4A | 177.3° | 176.9° |
| O2A | C2A | C1A | O5A | 178.3° | 177.5° |
| O2A | C2A | C1A | H48 | 64.2° | 62.5° |
| O2A | C2A | C3A | H54 | 65.7° | 57.1° |
| CAJ | CAK | CAL | H19 | 120.4° | 120.0° |
| CAJ | CAK | CAL | H20 | 120.3° | 120.0° |
| CAK | CAJ | CAI | H17 | 120.3° | 120.1° |
| CAK | CAJ | CAI | H18 | 120.3° | 120.0° |
| CAK | CAJ | CAI | CAH | 156.4° | 180.0° |
| CAJ | CAK | CAL | CAM | 98.4° | 180.0° |
| CAK | CAJ | CAI | H15 | 83.4° | 59.9° |
| CAK | CAJ | CAI | H16 | 36.3° | 60.0° |
| CAK | CAJ | H17 | H18 | 119.0° | 120.0° |
| CAJ | CAK | H19 | H20 | 118.9° | 120.0° |
| CAJ | CAK | CAL | H21 | 22.1° | 59.9° |
| CAJ | CAK | CAL | H22 | 141.1° | 60.0° |
| CAL | CAK | CAJ | CAI | 104.2° | 180.0° |
| CAK | CAL | CAM | H21 | 120.5° | 120.0° |
| CAK | CAL | CAM | H22 | 120.5° | 120.0° |
| CAK | CAL | CAM | CAN | 107.2° | 180.0° |
| CAL | CAK | CAJ | H17 | 16.2° | 60.0° |
| CAL | CAK | CAJ | H18 | 135.5° | 60.0° |
| CAL | CAK | H19 | H20 | 118.9° | 120.0° |
| CAK | CAL | H21 | H22 | 118.5° | 119.9° |
| CAK | CAL | CAM | H23 | 132.6° | 60.0° |
| CAK | CAL | CAM | H24 | 13.0° | 60.0° |
| N2 | C2 | C1 | H49 | 115.9° | 120.0° |
| C2 | N2 | CAA | H51 | 180.0° | 179.9° |
| N2 | C2 | C1 | O1A | 70.5° | 65.5° |
| C2 | N2 | CAA | CAB | 176.9° | 180.0° |
| C2 | N2 | CAA | OAA | 1.2° | 0.3° |
| N2 | C2 | C1 | H46 | 169.3° | 54.5° |
| N2 | C2 | C1 | H47 | 49.6° | 174.4° |
| N2 | C2 | C3 | H53 | 41.3° | 54.3° |
| C1 | C2 | N2 | CAA | 88.7° | 85.0° |
| C2 | C1 | O1A | H46 | 120.2° | 120.0° |
| C2 | C1 | O1A | H47 | 120.2° | 120.0° |
| C2 | C1 | O1A | C1A | 162.2° | 180.0° |
| C2 | C1 | H46 | H47 | 119.4° | 119.9° |
| C1 | C2 | N2 | H51 | 91.3° | 95.0° |
| C1 | C2 | C3 | H53 | 83.0° | 65.7° |
| CAJ | CAI | CAH | H15 | 120.2° | 120.0° |
| CAJ | CAI | CAH | H16 | 120.2° | 120.0° |
| CAJ | CAI | CAH | CAG | 143.7° | 180.0° |
| CAJ | CAI | CAH | H13 | 23.4° | 60.0° |
| CAJ | CAI | CAH | H14 | 95.9° | 59.9° |
| CAJ | CAI | H15 | H16 | 119.6° | 119.9° |
| CAI | CAJ | H17 | H18 | 119.1° | 119.9° |
| CAI | CAJ | CAK | H19 | 16.2° | 60.0° |
| CAI | CAJ | CAK | H20 | 135.5° | 60.0° |
| CAI | CAH | CAG | CAF | 99.8° | 180.0° |
| CAI | CAH | CAG | H13 | 120.4° | 120.0° |
| CAI | CAH | CAG | H14 | 120.4° | 120.0° |
| CAI | CAH | CAG | H11 | 139.9° | 60.0° |
| CAI | CAH | CAG | H12 | 20.4° | 60.0° |
| CAI | CAH | H13 | H14 | 118.9° | 120.0° |
| CAH | CAI | H15 | H16 | 119.5° | 120.0° |
| CAH | CAI | CAJ | H17 | 36.1° | 60.0° |
| CAH | CAI | CAJ | H18 | 83.2° | 60.0° |
| O3A | C3A | C2A | C4A | 124.3° | 119.9° |
| O3A | C3A | C2A | H54 | 118.8° | 120.3° |
| O3A | C3A | C2A | C1A | 176.9° | 176.8° |
| O3A | C3A | C4A | H54 | 118.4° | 120.3° |
| O3A | C3A | C4A | O4A | 60.2° | 56.9° |
| O3A | C3A | C4A | C5M | 178.4° | 176.9° |
| O3A | C3A | C2A | H50 | 66.3° | 57.0° |
| O3A | C3A | C4A | H58 | 61.0° | 63.2° |
| N2 | CAA | CAB | CAC | 107.9° | 179.7° |
| N2 | CAA | CAB | OAA | 178.3° | 179.7° |
| N2 | CAA | CAB | H1 | 132.7° | 60.3° |
| N2 | CAA | CAB | H2 | 11.5° | 59.8° |
| CAA | N2 | C2 | H49 | 26.7° | 34.9° |
| C3A | C2A | C1A | H50 | 116.8° | 119.8° |
| C3A | C2A | C1A | O1A | 69.6° | 62.4° |
| C2A | C3A | C4A | H54 | 117.0° | 119.8° |
| C3A | C2A | C1A | O5A | 54.2° | 57.6° |
| C2A | C3A | C4A | O4A | 64.5° | 63.0° |
| C2A | C3A | C4A | C5M | 57.0° | 57.0° |
| C3A | C2A | C1A | H48 | 171.7° | 177.6° |
| C3A | C2A | O2A | H52 | 180.0° | 180.0° |
| C2A | C3A | O3A | H56 | 180.0° | 60.0° |
| C2A | C3A | C4A | H58 | 174.3° | 176.9° |
| C2A | C1A | O1A | C1 | 171.9° | 170.0° |
| C2A | C1A | O1A | O5A | 121.7° | 120.0° |
| C2A | C1A | O1A | H48 | 117.9° | 120.0° |
| C1A | C2A | C3A | C4A | 58.8° | 56.9° |
| C2A | C1A | O5A | H48 | 116.8° | 120.0° |
| C2A | C1A | O5A | C5M | 54.7° | 61.1° |
| C1A | C2A | O2A | H52 | 57.0° | 60.3° |
| C1A | C2A | C3A | H54 | 58.2° | 62.9° |
| C1 | O1A | C1A | O5A | 66.4° | 70.0° |
| O1A | C1 | H46 | H47 | 119.4° | 120.1° |
| C1 | O1A | C1A | H48 | 54.0° | 50.0° |
| O1A | C1 | C2 | H49 | 173.5° | 174.5° |
| O1A | C1A | O5A | H48 | 120.5° | 120.0° |
| O1A | C1A | O5A | C5M | 68.1° | 58.8° |
| C1A | O1A | C1 | H46 | 42.0° | 60.0° |
| C1A | O1A | C1 | H47 | 77.6° | 60.0° |
| O1A | C1A | C2A | H50 | 173.6° | 177.7° |
| CAG | CAF | CAE | H9 | 120.0° | 120.0° |
| CAG | CAF | CAE | H10 | 119.9° | 119.9° |
| CAG | CAF | CAE | CAD | 150.7° | 180.0° |
| CAF | CAG | CAH | H11 | 120.2° | 120.0° |
| CAF | CAG | CAH | H12 | 120.2° | 120.0° |
| CAG | CAF | CAE | H7 | 30.1° | 60.0° |
| CAG | CAF | CAE | H8 | 88.6° | 60.0° |
| CAG | CAF | H9 | H10 | 120.2° | 120.0° |
| CAF | CAG | H11 | H12 | 119.3° | 120.1° |
| CAF | CAG | CAH | H13 | 139.8° | 60.0° |
| CAF | CAG | CAH | H14 | 20.5° | 60.0° |
| CAF | CAE | CAD | CAC | 96.2° | 180.0° |
| CAF | CAE | CAD | H7 | 120.6° | 120.0° |
| CAF | CAE | CAD | H8 | 120.6° | 120.0° |
| CAE | CAF | CAG | CAH | 140.1° | 180.0° |
| CAF | CAE | CAD | H5 | 23.9° | 60.0° |
| CAF | CAE | CAD | H6 | 143.7° | 60.0° |
| CAF | CAE | H7 | H8 | 118.0° | 120.0° |
| CAE | CAF | H9 | H10 | 120.2° | 120.0° |
| CAE | CAF | CAG | H11 | 19.8° | 60.1° |
| CAE | CAF | CAG | H12 | 99.7° | 60.1° |
| CAD | CAC | CAB | H3 | 120.5° | 120.0° |
| CAD | CAC | CAB | H4 | 120.5° | 120.0° |
| CAC | CAD | CAE | H5 | 120.1° | 120.0° |
| CAC | CAD | CAE | H6 | 120.1° | 120.0° |
| CAD | CAC | CAB | CAA | 176.2° | 180.0° |
| CAD | CAC | CAB | H1 | 56.8° | 60.0° |
| CAD | CAC | CAB | H2 | 64.5° | 60.0° |
| CAD | CAC | H3 | H4 | 118.6° | 119.9° |
| CAC | CAD | H5 | H6 | 119.7° | 120.0° |
| CAC | CAD | CAE | H7 | 24.4° | 60.0° |
| CAC | CAD | CAE | H8 | 143.1° | 60.0° |
| CAB | CAC | CAD | CAE | 123.1° | 180.0° |
| CAC | CAB | CAA | H1 | 119.4° | 120.0° |
| CAC | CAB | CAA | H2 | 119.4° | 119.9° |
| CAC | CAB | CAA | OAA | 70.4° | 0.0° |
| CAC | CAB | H1 | H2 | 121.9° | 120.0° |
| CAB | CAC | H3 | H4 | 118.6° | 120.0° |
| CAB | CAC | CAD | H5 | 116.8° | 60.0° |
| CAB | CAC | CAD | H6 | 3.0° | 60.0° |
| CAE | CAD | CAC | H3 | 116.5° | 60.0° |
| CAE | CAD | CAC | H4 | 2.6° | 60.0° |
| CAE | CAD | H5 | H6 | 119.7° | 120.0° |
| CAD | CAE | H7 | H8 | 118.0° | 120.0° |
| CAD | CAE | CAF | H9 | 89.3° | 60.1° |
| CAD | CAE | CAF | H10 | 30.8° | 60.0° |
| CAL | CAM | CAN | H23 | 120.2° | 120.0° |
| CAL | CAM | CAN | H24 | 120.2° | 120.0° |
| CAL | CAM | CAN | CAO | 168.6° | 180.0° |
| CAM | CAL | CAK | H19 | 141.2° | 60.0° |
| CAM | CAL | CAK | H20 | 21.9° | 60.0° |
| CAM | CAL | H21 | H22 | 118.5° | 120.0° |
| CAL | CAM | H23 | H24 | 119.4° | 120.0° |
| CAL | CAM | CAN | H25 | 71.1° | 60.0° |
| CAL | CAM | CAN | H26 | 48.4° | 60.0° |
| C3A | C4A | O4A | C5M | 119.9° | 119.7° |
| C3A | C4A | O4A | H58 | 120.4° | 120.1° |
| C3A | C4A | C5M | H58 | 117.4° | 119.9° |
| C3A | C4A | C5M | O5A | 53.0° | 57.6° |
| C3A | C4A | C5M | C6A | 179.0° | 177.6° |
| C4A | C3A | C2A | H50 | 58.0° | 62.9° |
| C4A | C3A | O3A | H56 | 55.5° | 179.6° |
| C3A | C4A | O4A | H60 | 180.0° | 59.9° |
| C3A | C4A | C5M | H63 | 63.0° | 62.4° |
| C1A | O5A | C5M | C4A | 55.3° | 61.2° |
| C1A | O5A | C5M | C6A | 175.6° | 178.8° |
| O5A | C1A | C2A | H50 | 62.7° | 62.3° |
| C1A | O5A | C5M | H63 | 60.1° | 58.8° |
| CAA | CAB | H1 | H2 | 121.9° | 120.0° |
| CAA | CAB | CAC | H3 | 63.4° | 60.0° |
| CAA | CAB | CAC | H4 | 55.7° | 60.0° |
| CAB | CAA | N2 | H51 | 3.1° | 0.0° |
| OAA | CAA | CAB | H1 | 49.0° | 120.0° |
| OAA | CAA | CAB | H2 | 170.3° | 120.0° |
| OAA | CAA | N2 | H51 | 178.8° | 179.7° |
| CAH | CAG | CAF | H9 | 20.1° | 60.0° |
| CAH | CAG | CAF | H10 | 100.0° | 60.0° |
| CAH | CAG | H11 | H12 | 119.3° | 120.0° |
| CAG | CAH | H13 | H14 | 118.9° | 120.0° |
| CAG | CAH | CAI | H15 | 96.1° | 60.0° |
| CAG | CAH | CAI | H16 | 23.5° | 60.0° |
| CAM | CAN | CAO | H25 | 120.3° | 119.9° |
| CAM | CAN | CAO | H26 | 120.2° | 119.9° |
| CAM | CAN | CAO | CAP | 169.5° | 127.6° |
| CAN | CAM | CAL | H21 | 13.3° | 60.0° |
| CAN | CAM | CAL | H22 | 132.4° | 60.0° |
| CAN | CAM | H23 | H24 | 119.4° | 120.0° |
| CAM | CAN | H25 | H26 | 119.2° | 120.0° |
| CAM | CAN | CAO | H27 | 10.4° | 52.5° |
| O4A | C4A | C5M | H58 | 120.4° | 120.1° |
| O4A | C4A | C5M | O5A | 69.2° | 62.3° |
| O4A | C4A | C5M | C6A | 58.8° | 57.7° |
| O4A | C4A | C3A | H54 | 178.6° | 177.2° |
| O4A | C4A | C5M | H63 | 174.8° | 177.7° |
| C4A | C5M | O5A | C6A | 129.0° | 120.0° |
| C4A | C5M | O5A | H63 | 115.4° | 120.0° |
| C4A | C5M | C6A | H63 | 116.0° | 120.0° |
| C4A | C5M | C6A | O6A | 178.5° | 175.0° |
| C5M | C4A | C3A | H54 | 60.0° | 62.8° |
| C5M | C4A | O4A | H60 | 60.1° | 179.7° |
| C4A | C5M | C6A | H67 | 58.7° | 55.0° |
| C4A | C5M | C6A | H68 | 61.6° | 65.0° |
| O5A | C5M | C6A | H63 | 116.1° | 120.0° |
| O5A | C5M | C6A | O6A | 53.6° | 65.0° |
| C5M | O5A | C1A | H48 | 171.4° | 178.8° |
| O5A | C5M | C4A | H58 | 170.4° | 177.5° |
| O5A | C5M | C6A | H67 | 173.5° | 175.0° |
| O5A | C5M | C6A | H68 | 66.2° | 54.9° |
| CAN | CAO | CAP | H27 | 180.0° | 179.9° |
| CAN | CAO | CAP | CAQ | 0.5° | 6.7° |
| CAO | CAN | CAM | H23 | 48.4° | 60.0° |
| CAO | CAN | CAM | H24 | 71.1° | 60.0° |
| CAO | CAN | H25 | H26 | 119.3° | 120.1° |
| CAN | CAO | CAP | H28 | 179.5° | 173.2° |
| C5M | C6A | O6A | H67 | 119.8° | 120.0° |
| C5M | C6A | O6A | H68 | 119.8° | 120.0° |
| C6A | C5M | C4A | H58 | 61.6° | 62.5° |
| C5M | C6A | O6A | H64 | 180.0° | 180.0° |
| C5M | C6A | H67 | H68 | 120.5° | 120.0° |
| CAX | CAW | CAV | H41 | 120.7° | 120.0° |
| CAX | CAW | CAV | H42 | 120.8° | 119.9° |
| CAX | CAW | CAV | CAU | 120.7° | 180.0° |
| CAX | CAW | CAV | H39 | 118.5° | 60.0° |
| CAX | CAW | CAV | H40 | 0.0° | 60.1° |
| CAX | CAW | H41 | H42 | 117.8° | 120.0° |
| CAW | CAX | H43 | H44 | 120.0° | 120.0° |
| CAW | CAX | H43 | H45 | 120.0° | 120.0° |
| CAW | CAX | H44 | H45 | 120.0° | 119.9° |
| CAO | CAP | CAQ | H28 | 180.0° | 179.9° |
| CAO | CAP | CAQ | CAR | 118.0° | 126.7° |
| CAP | CAO | CAN | H25 | 49.3° | 7.7° |
| CAP | CAO | CAN | H26 | 70.2° | 112.4° |
| CAO | CAP | CAQ | H29 | 2.3° | 113.4° |
| CAO | CAP | CAQ | H30 | 121.7° | 6.7° |
| CAW | CAV | CAU | H39 | 120.7° | 120.1° |
| CAW | CAV | CAU | H40 | 120.7° | 119.9° |
| CAW | CAV | CAU | CAT | 47.7° | 180.0° |
| CAW | CAV | CAU | H37 | 168.5° | 60.0° |
| CAW | CAV | CAU | H38 | 73.2° | 60.0° |
| CAW | CAV | H39 | H40 | 117.8° | 120.0° |
| CAV | CAW | H41 | H42 | 117.7° | 120.0° |
| CAV | CAW | CAX | H43 | 180.0° | 180.0° |
| CAV | CAW | CAX | H44 | 60.0° | 59.9° |
| CAV | CAW | CAX | H45 | 60.0° | 60.0° |
| O6A | C6A | C5M | H63 | 62.5° | 55.0° |
| O6A | C6A | H67 | H68 | 120.5° | 120.0° |
| CAP | CAQ | CAR | H29 | 120.3° | 120.0° |
| CAP | CAQ | CAR | H30 | 120.3° | 120.0° |
| CAP | CAQ | CAR | CAS | 179.3° | 180.0° |
| CAQ | CAP | CAO | H27 | 179.5° | 173.2° |
| CAP | CAQ | H29 | H30 | 119.1° | 120.1° |
| CAP | CAQ | CAR | H31 | 60.5° | 59.9° |
| CAP | CAQ | CAR | H32 | 59.0° | 60.1° |
| CAV | CAU | CAT | H37 | 120.9° | 120.0° |
| CAV | CAU | CAT | H38 | 120.8° | 119.9° |
| CAV | CAU | CAT | CAS | 158.2° | 180.0° |
| CAV | CAU | CAT | H35 | 37.7° | 60.0° |
| CAV | CAU | CAT | H36 | 81.3° | 60.1° |
| CAV | CAU | H37 | H38 | 117.4° | 119.9° |
| CAU | CAV | H39 | H40 | 117.8° | 120.0° |
| CAU | CAV | CAW | H41 | 0.0° | 60.0° |
| CAU | CAV | CAW | H42 | 118.5° | 60.1° |
| CAQ | CAR | CAS | H31 | 120.2° | 120.0° |
| CAQ | CAR | CAS | H32 | 120.2° | 119.9° |
| CAQ | CAR | CAS | CAT | 139.4° | 180.0° |
| CAR | CAQ | CAP | H28 | 62.0° | 53.4° |
| CAR | CAQ | H29 | H30 | 119.1° | 119.9° |
| CAQ | CAR | H31 | H32 | 119.3° | 120.0° |
| CAQ | CAR | CAS | H33 | 19.3° | 60.0° |
| CAQ | CAR | CAS | H34 | 100.4° | 60.1° |
| CAR | CAS | CAT | CAU | 153.0° | 180.0° |
| CAR | CAS | CAT | H33 | 120.2° | 120.0° |
| CAR | CAS | CAT | H34 | 120.2° | 119.9° |
| CAS | CAR | CAQ | H29 | 58.9° | 60.0° |
| CAS | CAR | CAQ | H30 | 60.4° | 60.0° |
| CAS | CAR | H31 | H32 | 119.4° | 120.0° |
| CAR | CAS | H33 | H34 | 119.5° | 120.0° |
| CAR | CAS | CAT | H35 | 32.4° | 59.9° |
| CAR | CAS | CAT | H36 | 86.5° | 60.0° |
| CAU | CAT | CAS | H35 | 120.5° | 120.0° |
| CAU | CAT | CAS | H36 | 120.5° | 120.0° |
| CAU | CAT | CAS | H33 | 32.8° | 60.0° |
| CAU | CAT | CAS | H34 | 86.9° | 60.1° |
| CAU | CAT | H35 | H36 | 118.4° | 120.1° |
| CAT | CAU | H37 | H38 | 117.4° | 120.1° |
| CAT | CAU | CAV | H39 | 73.1° | 60.0° |
| CAT | CAU | CAV | H40 | 168.4° | 60.1° |
| CAT | CAS | CAR | H31 | 100.4° | 60.0° |
| CAT | CAS | CAR | H32 | 19.2° | 60.1° |
| CAT | CAS | H33 | H34 | 119.5° | 120.0° |
| CAS | CAT | H35 | H36 | 118.4° | 119.9° |
| CAS | CAT | CAU | H37 | 80.9° | 60.0° |
| CAS | CAT | CAU | H38 | 37.4° | 60.1° |
| H1 | CAB | CAC | H3 | 177.3° | 180.0° |
| H1 | CAB | CAC | H4 | 63.7° | 60.0° |
| H2 | CAB | CAC | H3 | 56.0° | 60.0° |
| H2 | CAB | CAC | H4 | 175.1° | 180.0° |
| H3 | CAC | CAD | H5 | 3.6° | 180.0° |
| H3 | CAC | CAD | H6 | 123.5° | 60.0° |
| H4 | CAC | CAD | H5 | 122.7° | 60.0° |
| H4 | CAC | CAD | H6 | 117.5° | 180.0° |
| H5 | CAD | CAE | H7 | 144.5° | 180.0° |
| H5 | CAD | CAE | H8 | 96.8° | 60.0° |
| H6 | CAD | CAE | H7 | 95.7° | 60.0° |
| H6 | CAD | CAE | H8 | 23.0° | 180.0° |
| H7 | CAE | CAF | H9 | 150.0° | 179.9° |
| H7 | CAE | CAF | H10 | 89.9° | 60.0° |
| H8 | CAE | CAF | H9 | 31.3° | 60.0° |
| H8 | CAE | CAF | H10 | 151.4° | 179.9° |
| H9 | CAF | CAG | H11 | 100.1° | 180.0° |
| H9 | CAF | CAG | H12 | 140.3° | 59.9° |
| H10 | CAF | CAG | H11 | 139.8° | 59.9° |
| H10 | CAF | CAG | H12 | 20.2° | 180.0° |
| H11 | CAG | CAH | H13 | 19.6° | 180.0° |
| H11 | CAG | CAH | H14 | 99.7° | 60.0° |
| H12 | CAG | CAH | H13 | 100.0° | 60.0° |
| H12 | CAG | CAH | H14 | 140.7° | 180.0° |
| H13 | CAH | CAI | H15 | 143.5° | 180.0° |
| H13 | CAH | CAI | H16 | 96.8° | 60.0° |
| H14 | CAH | CAI | H15 | 24.2° | 60.0° |
| H14 | CAH | CAI | H16 | 143.9° | 180.0° |
| H15 | CAI | CAJ | H17 | 156.3° | 180.0° |
| H15 | CAI | CAJ | H18 | 36.9° | 60.1° |
| H16 | CAI | CAJ | H17 | 84.0° | 60.1° |
| H16 | CAI | CAJ | H18 | 156.6° | 180.0° |
| H17 | CAJ | CAK | H19 | 136.5° | 180.0° |
| H17 | CAJ | CAK | H20 | 104.2° | 60.0° |
| H18 | CAJ | CAK | H19 | 104.2° | 60.0° |
| H18 | CAJ | CAK | H20 | 15.1° | 179.9° |
| H19 | CAK | CAL | H21 | 98.3° | 180.0° |
| H19 | CAK | CAL | H22 | 20.7° | 60.0° |
| H20 | CAK | CAL | H21 | 142.4° | 60.0° |
| H20 | CAK | CAL | H22 | 98.6° | 180.0° |
| H21 | CAL | CAM | H23 | 106.9° | 180.0° |
| H21 | CAL | CAM | H24 | 133.5° | 60.0° |
| H22 | CAL | CAM | H23 | 12.2° | 60.0° |
| H22 | CAL | CAM | H24 | 107.4° | 180.0° |
| H23 | CAM | CAN | H25 | 168.7° | 180.0° |
| H23 | CAM | CAN | H26 | 71.8° | 60.0° |
| H24 | CAM | CAN | H25 | 49.1° | 60.0° |
| H24 | CAM | CAN | H26 | 168.6° | 180.0° |
| H25 | CAN | CAO | H27 | 130.7° | 172.4° |
| H26 | CAN | CAO | H27 | 109.8° | 67.5° |
| H27 | CAO | CAP | H28 | 0.5° | 6.9° |
| H28 | CAP | CAQ | H29 | 177.7° | 66.5° |
| H28 | CAP | CAQ | H30 | 58.3° | 173.4° |
| H29 | CAQ | CAR | H31 | 179.1° | 180.0° |
| H29 | CAQ | CAR | H32 | 61.3° | 60.0° |
| H30 | CAQ | CAR | H31 | 59.8° | 60.0° |
| H30 | CAQ | CAR | H32 | 179.3° | 179.9° |
| H31 | CAR | CAS | H33 | 139.5° | 179.9° |
| H31 | CAR | CAS | H34 | 19.8° | 60.0° |
| H32 | CAR | CAS | H33 | 101.0° | 59.9° |
| H32 | CAR | CAS | H34 | 139.4° | 180.0° |
| H33 | CAS | CAT | H35 | 87.8° | 180.0° |
| H33 | CAS | CAT | H36 | 153.3° | 60.0° |
| H34 | CAS | CAT | H35 | 152.6° | 60.0° |
| H34 | CAS | CAT | H36 | 33.6° | 179.9° |
| H35 | CAT | CAU | H37 | 158.5° | 179.9° |
| H35 | CAT | CAU | H38 | 83.1° | 60.0° |
| H36 | CAT | CAU | H37 | 39.6° | 59.9° |
| H36 | CAT | CAU | H38 | 157.9° | 180.0° |
| H37 | CAU | CAV | H39 | 47.8° | 180.0° |
| H37 | CAU | CAV | H40 | 70.8° | 60.0° |
| H38 | CAU | CAV | H39 | 166.1° | 60.0° |
| H38 | CAU | CAV | H40 | 47.5° | 179.9° |
| H39 | CAV | CAW | H41 | 120.8° | NaN° |
| H39 | CAV | CAW | H42 | 2.2° | 60.0° |
| H40 | CAV | CAW | H41 | 120.7° | 60.0° |
| H40 | CAV | CAW | H42 | 120.8° | 180.0° |
| H41 | CAW | CAX | H43 | 59.3° | 60.0° |
| H41 | CAW | CAX | H44 | 60.7° | NaN° |
| H41 | CAW | CAX | H45 | 179.3° | 60.0° |
| H42 | CAW | CAX | H43 | 59.3° | 60.0° |
| H42 | CAW | CAX | H44 | 179.3° | 60.0° |
| H42 | CAW | CAX | H45 | 60.7° | 179.9° |
| H43 | CAX | H44 | H45 | 120.0° | 120.0° |
| H46 | C1 | C2 | H49 | 53.3° | 65.5° |
| H47 | C1 | C2 | H49 | 66.3° | 54.5° |
| H48 | C1A | C2A | H50 | 54.9° | 57.8° |
| H49 | C2 | N2 | H51 | 153.3° | 145.0° |
| H49 | C2 | C3 | H53 | 158.2° | 174.3° |
| H50 | C2A | O2A | H52 | 61.3° | 59.9° |
| H50 | C2A | C3A | H54 | 174.9° | 177.3° |
| H53 | C3 | O3 | H55 | 63.1° | 175.1° |
| H53 | C3 | C4 | H57 | 82.3° | 180.0° |
| H54 | C3A | O3A | H56 | 62.0° | 60.2° |
| H54 | C3A | C4A | H58 | 57.3° | 57.1° |
| H57 | C4 | O4 | H59 | 67.6° | 180.0° |
| H57 | C4 | C5 | H61 | 123.4° | 65.0° |
| H57 | C4 | C5 | H62 | 3.7° | 175.0° |
| H58 | C4A | O4A | H60 | 59.5° | 60.2° |
| H58 | C4A | C5M | H63 | 54.4° | 57.5° |
| H61 | C5 | C6 | H65 | 166.3° | 180.0° |
| H61 | C5 | C6 | H66 | 46.8° | 60.1° |
| H62 | C5 | C6 | H65 | 74.0° | 60.0° |
| H62 | C5 | C6 | H66 | 166.5° | 179.9° |
| H63 | C5M | C6A | H67 | 57.3° | 65.0° |
| H63 | C5M | C6A | H68 | 177.7° | 174.9° |
| H64 | O6A | C6A | H67 | 60.1° | 60.0° |
| H64 | O6A | C6A | H68 | 60.2° | 60.1° |
| H65 | C6 | C7 | H69 | 113.3° | 180.0° |
| H65 | C6 | C7 | H70 | 126.7° | 60.0° |
| H66 | C6 | C7 | H69 | 6.3° | 60.0° |
| H66 | C6 | C7 | H70 | 113.8° | 180.0° |
| H69 | C7 | C8 | H71 | 103.0° | NaN° |
| H69 | C7 | C8 | H72 | 16.2° | 60.0° |
| H70 | C7 | C8 | H71 | 136.9° | 60.0° |
| H70 | C7 | C8 | H72 | 103.8° | 180.0° |
| H71 | C8 | C9 | H73 | 160.0° | 180.0° |
| H71 | C8 | C9 | H74 | 39.8° | 60.0° |
| H72 | C8 | C9 | H73 | 80.8° | 60.0° |
| H72 | C8 | C9 | H74 | 159.0° | 180.0° |
| H73 | C9 | C10 | H75 | 159.2° | 180.0° |
| H73 | C9 | C10 | H76 | 39.5° | 60.0° |
| H74 | C9 | C10 | H75 | 80.6° | 60.0° |
| H74 | C9 | C10 | H76 | 159.7° | 180.0° |
| H75 | C10 | C11 | H77 | 117.7° | 180.0° |
| H75 | C10 | C11 | H78 | 122.9° | 60.1° |
| H76 | C10 | C11 | H77 | 2.0° | 60.1° |
| H76 | C10 | C11 | H78 | 117.4° | 180.0° |
| H77 | C11 | C12 | H79 | 147.7° | 180.0° |
| H77 | C11 | C12 | H80 | 27.6° | 60.0° |
| H78 | C11 | C12 | H79 | 92.9° | 60.1° |
| H78 | C11 | C12 | H80 | 147.0° | 179.9° |
| H79 | C12 | C13 | H81 | 127.0° | 180.0° |
| H79 | C12 | C13 | H82 | 7.6° | 60.1° |
| H80 | C12 | C13 | H81 | 112.9° | 60.0° |
| H80 | C12 | C13 | H82 | 127.7° | 180.0° |
| H81 | C13 | C14 | H83 | 109.9° | 180.0° |
| H81 | C13 | C14 | H84 | 9.9° | 60.0° |
| H82 | C13 | C14 | H83 | 130.7° | 60.0° |
| H82 | C13 | C14 | H84 | 109.5° | 179.9° |
| H83 | C14 | C15 | H85 | 178.6° | 180.0° |
| H83 | C14 | C15 | H86 | 59.0° | 59.9° |
| H84 | C14 | C15 | H85 | 61.5° | 60.0° |
| H84 | C14 | C15 | H86 | 178.8° | 180.0° |
| H85 | C15 | C16 | H87 | 148.9° | 180.0° |
| H85 | C15 | C16 | H88 | 91.6° | 60.0° |
| H86 | C15 | C16 | H87 | 29.2° | 60.0° |
| H86 | C15 | C16 | H88 | 148.8° | 180.0° |
| H87 | C16 | C17 | H89 | 117.6° | 180.0° |
| H87 | C16 | C17 | H90 | 122.7° | 60.0° |
| H88 | C16 | C17 | H89 | 2.0° | 60.0° |
| H88 | C16 | C17 | H90 | 117.7° | 180.0° |
| H89 | C17 | C18 | H91 | 59.8° | 60.0° |
| H89 | C17 | C18 | H92 | 60.1° | 180.0° |
| H89 | C17 | C18 | H93 | 179.9° | 60.0° |
| H90 | C17 | C18 | H91 | 59.9° | 60.0° |
| H90 | C17 | C18 | H92 | 179.9° | 60.0° |
| H90 | C17 | C18 | H93 | 60.2° | 180.0° |
| H91 | C18 | H92 | H93 | 120.0° | 120.0° |
