ZMO
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O23 | P24 | sing | 1.61Å | 1.67Å | |
P24 | O26 | doub | 1.48Å | 1.67Å | |
P24 | O27 | sing | 1.61Å | 1.83Å | |
O27 | C28 | sing | 1.43Å | 1.42Å | |
C28 | C29 | sing | 1.53Å | 1.52Å | |
C28 | H28 | sing | 1.09Å | 1.10Å | |
C28 | H28A | sing | 1.09Å | 1.10Å | |
C29 | C31 | sing | 1.53Å | 1.52Å | |
C29 | C30 | sing | 1.53Å | 1.53Å | |
C29 | C32 | sing | 1.53Å | 1.53Å | |
C31 | H31 | sing | 1.09Å | 1.10Å | |
C31 | H31A | sing | 1.09Å | 1.10Å | |
C31 | H31B | sing | 1.09Å | 1.10Å | |
C30 | H30 | sing | 1.09Å | 1.10Å | |
C30 | H30A | sing | 1.09Å | 1.10Å | |
C30 | H30B | sing | 1.09Å | 1.10Å | |
C32 | O33 | sing | 1.43Å | 1.44Å | |
C32 | C34 | sing | 1.51Å | 1.50Å | |
C32 | H32 | sing | 1.09Å | 1.10Å | |
O33 | HO33 | sing | 0.97Å | 0.95Å | |
C34 | O35 | doub | 1.21Å | 1.33Å | |
C34 | N36 | sing | 1.35Å | 1.27Å | |
N36 | C37 | sing | 1.47Å | 1.46Å | |
N36 | HN36 | sing | 0.97Å | 1.00Å | |
C37 | C38 | sing | 1.53Å | 1.52Å | |
C37 | H37 | sing | 1.09Å | 1.10Å | |
C37 | H37A | sing | 1.09Å | 1.10Å | |
C38 | C39 | sing | 1.51Å | 1.51Å | |
C38 | H38 | sing | 1.09Å | 1.10Å | |
C38 | H38A | sing | 1.09Å | 1.10Å | |
C39 | O40 | doub | 1.21Å | 1.33Å | |
C39 | N41 | sing | 1.35Å | 1.26Å | |
N41 | C42 | sing | 1.46Å | 1.46Å | |
N41 | HN41 | sing | 0.97Å | 1.00Å | |
C42 | C43 | sing | 1.53Å | 1.52Å | |
C42 | H42 | sing | 1.09Å | 1.10Å | |
C42 | H42A | sing | 1.09Å | 1.10Å | |
C43 | S1 | sing | 1.81Å | 1.76Å | |
C43 | H43 | sing | 1.09Å | 1.10Å | |
C43 | H43A | sing | 1.09Å | 1.10Å | |
S1 | C1 | sing | 1.71Å | 1.77Å | |
C1 | O1 | doub | 1.21Å | 1.33Å | |
C1 | C2 | sing | 1.51Å | 1.52Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H2A | sing | 1.09Å | 1.10Å | |
C3 | C4 | sing | 1.53Å | 1.52Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H3A | sing | 1.09Å | 1.10Å | |
C4 | C5 | sing | 1.53Å | 1.52Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H4A | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.53Å | 1.52Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H5A | sing | 1.09Å | 1.10Å | |
C6 | C7 | sing | 1.53Å | 1.53Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
C6 | H6A | sing | 1.09Å | 1.10Å | |
C7 | C8 | sing | 1.53Å | 1.52Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
C7 | H7A | sing | 1.09Å | 1.10Å | |
C8 | C9 | sing | 1.51Å | 1.52Å | |
C8 | H8 | sing | 1.09Å | 1.10Å | |
C8 | H8A | sing | 1.09Å | 1.10Å | |
C9 | C10 | doub | 1.31Å | 1.33Å | |
C9 | H9 | sing | 1.08Å | 1.08Å | |
C10 | C11 | sing | 1.51Å | 1.53Å | |
C10 | H10 | sing | 1.08Å | 1.08Å | |
C11 | C12 | sing | 1.53Å | 1.52Å | |
C11 | H11 | sing | 1.09Å | 1.10Å | |
C11 | H11A | sing | 1.09Å | 1.10Å | |
C12 | C13 | sing | 1.53Å | 1.52Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C12 | H12A | sing | 1.09Å | 1.10Å | |
C13 | C14 | sing | 1.53Å | 1.52Å | |
C13 | H13 | sing | 1.09Å | 1.10Å | |
C13 | H13A | sing | 1.09Å | 1.10Å | |
C14 | C15 | sing | 1.53Å | 1.52Å | |
C14 | H14 | sing | 1.09Å | 1.10Å | |
C14 | H14A | sing | 1.09Å | 1.10Å | |
C15 | C16 | sing | 1.53Å | 1.51Å | |
C15 | H15 | sing | 1.09Å | 1.10Å | |
C15 | H15A | sing | 1.09Å | 1.10Å | |
C16 | H16A | sing | 1.09Å | 1.10Å | |
C16 | H16B | sing | 1.09Å | 1.10Å | |
C16 | C17 | sing | 1.53Å | 1.62Å | |
C17 | C18 | sing | 1.53Å | 1.54Å | |
C17 | H50 | sing | 1.09Å | 1.10Å | |
C17 | H51 | sing | 1.09Å | 1.10Å | |
C18 | H52 | sing | 1.09Å | 1.10Å | |
C18 | H53 | sing | 1.09Å | 1.10Å | |
C18 | H54 | sing | 1.09Å | 1.10Å | |
P24 | O28 | sing | 1.61Å | 113.11Å | |
O28 | HO28 | sing | 0.97Å | 0.00Å | |
O23 | HO23 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O23 | P24 | O26 | 118.5° | 109.5° |
O23 | P24 | O27 | 117.8° | 109.5° |
O23 | P24 | O28 | 28.7° | 109.5° |
P24 | O23 | HO23 | 109.5° | 114.0° |
O26 | P24 | O27 | 117.2° | 109.5° |
O26 | P24 | O28 | 143.4° | 109.5° |
P24 | O27 | C28 | 119.0° | 123.0° |
O27 | P24 | O28 | 89.2° | 109.4° |
O27 | C28 | C29 | 109.6° | 109.5° |
O27 | C28 | H28 | 109.4° | 109.5° |
O27 | C28 | H28A | 109.5° | 109.5° |
C29 | C28 | H28 | 109.4° | 109.5° |
C29 | C28 | H28A | 109.4° | 109.4° |
C28 | C29 | C31 | 109.1° | 109.5° |
C28 | C29 | C30 | 108.8° | 109.5° |
C28 | C29 | C32 | 109.2° | 109.5° |
H28 | C28 | H28A | 109.5° | 109.5° |
C31 | C29 | C30 | 108.7° | 109.5° |
C31 | C29 | C32 | 109.4° | 109.4° |
C29 | C31 | H31 | 109.5° | 109.4° |
C29 | C31 | H31A | 109.5° | 109.5° |
C29 | C31 | H31B | 109.4° | 109.5° |
C30 | C29 | C32 | 111.7° | 109.5° |
C29 | C30 | H30 | 109.5° | 109.5° |
C29 | C30 | H30A | 109.4° | 109.4° |
C29 | C30 | H30B | 109.5° | 109.5° |
C29 | C32 | O33 | 111.3° | 109.4° |
C29 | C32 | C34 | 110.7° | 109.4° |
C29 | C32 | H32 | 107.5° | 109.5° |
H31 | C31 | H31A | 109.4° | 109.4° |
H31 | C31 | H31B | 109.5° | 109.5° |
H31A | C31 | H31B | 109.5° | 109.5° |
H30 | C30 | H30A | 109.5° | 109.5° |
H30 | C30 | H30B | 109.5° | 109.5° |
H30A | C30 | H30B | 109.5° | 109.5° |
O33 | C32 | C34 | 110.7° | 109.5° |
O33 | C32 | H32 | 108.7° | 109.5° |
C32 | O33 | HO33 | 109.5° | 114.0° |
C34 | C32 | H32 | 107.9° | 109.5° |
C32 | C34 | O35 | 118.4° | 120.0° |
C32 | C34 | N36 | 121.4° | 120.0° |
O35 | C34 | N36 | 120.2° | 120.0° |
C34 | N36 | C37 | 128.4° | 120.0° |
C34 | N36 | HN36 | 115.8° | 120.0° |
C37 | N36 | HN36 | 115.8° | 119.9° |
N36 | C37 | C38 | 106.2° | 109.5° |
N36 | C37 | H37 | 110.3° | 109.5° |
N36 | C37 | H37A | 110.3° | 109.4° |
C38 | C37 | H37 | 110.3° | 109.5° |
C38 | C37 | H37A | 110.3° | 109.5° |
C37 | C38 | C39 | 110.0° | 109.5° |
C37 | C38 | H38 | 109.3° | 109.5° |
C37 | C38 | H38A | 109.3° | 109.4° |
H37 | C37 | H37A | 109.4° | 109.4° |
C39 | C38 | H38 | 109.3° | 109.5° |
C39 | C38 | H38A | 109.3° | 109.5° |
C38 | C39 | O40 | 120.2° | 120.0° |
C38 | C39 | N41 | 119.7° | 120.0° |
H38 | C38 | H38A | 109.5° | 109.5° |
O40 | C39 | N41 | 120.1° | 120.0° |
C39 | N41 | C42 | 127.3° | 120.0° |
C39 | N41 | HN41 | 116.3° | 120.0° |
C42 | N41 | HN41 | 116.4° | 120.1° |
N41 | C42 | C43 | 105.3° | 109.4° |
N41 | C42 | H42 | 110.5° | 109.5° |
N41 | C42 | H42A | 110.5° | 109.5° |
C43 | C42 | H42 | 110.5° | 109.5° |
C43 | C42 | H42A | 110.5° | 109.4° |
C42 | C43 | S1 | 109.8° | 109.5° |
C42 | C43 | H43 | 109.4° | 109.5° |
C42 | C43 | H43A | 109.4° | 109.5° |
H42 | C42 | H42A | 109.5° | 109.5° |
S1 | C43 | H43 | 109.4° | 109.5° |
S1 | C43 | H43A | 109.4° | 109.4° |
C43 | S1 | C1 | 110.2° | 100.0° |
H43 | C43 | H43A | 109.5° | 109.4° |
S1 | C1 | O1 | 119.3° | 120.0° |
S1 | C1 | C2 | 119.4° | 120.0° |
O1 | C1 | C2 | 119.3° | 120.1° |
C1 | C2 | C3 | 110.8° | 109.4° |
C1 | C2 | H2 | 109.2° | 109.5° |
C1 | C2 | H2A | 109.1° | 109.5° |
C3 | C2 | H2 | 109.1° | 109.4° |
C3 | C2 | H2A | 109.1° | 109.4° |
C2 | C3 | C4 | 111.5° | 109.5° |
C2 | C3 | H3 | 109.0° | 109.5° |
C2 | C3 | H3A | 109.0° | 109.4° |
H2 | C2 | H2A | 109.5° | 109.5° |
C4 | C3 | H3 | 108.9° | 109.5° |
C4 | C3 | H3A | 108.9° | 109.5° |
C3 | C4 | C5 | 110.7° | 109.5° |
C3 | C4 | H4 | 109.1° | 109.5° |
C3 | C4 | H4A | 109.2° | 109.4° |
H3 | C3 | H3A | 109.5° | 109.5° |
C5 | C4 | H4 | 109.2° | 109.4° |
C5 | C4 | H4A | 109.2° | 109.5° |
C4 | C5 | C6 | 111.3° | 109.5° |
C4 | C5 | H5 | 109.0° | 109.4° |
C4 | C5 | H5A | 109.0° | 109.5° |
H4 | C4 | H4A | 109.5° | 109.5° |
C6 | C5 | H5 | 109.0° | 109.5° |
C6 | C5 | H5A | 109.0° | 109.5° |
C5 | C6 | C7 | 111.5° | 109.5° |
C5 | C6 | H6 | 108.9° | 109.5° |
C5 | C6 | H6A | 109.0° | 109.4° |
H5 | C5 | H5A | 109.5° | 109.5° |
C7 | C6 | H6 | 109.0° | 109.5° |
C7 | C6 | H6A | 109.0° | 109.5° |
C6 | C7 | C8 | 111.6° | 109.5° |
C6 | C7 | H7 | 108.9° | 109.5° |
C6 | C7 | H7A | 108.9° | 109.5° |
H6 | C6 | H6A | 109.5° | 109.5° |
C8 | C7 | H7 | 108.9° | 109.4° |
C8 | C7 | H7A | 108.9° | 109.4° |
C7 | C8 | C9 | 110.7° | 109.5° |
C7 | C8 | H8 | 109.2° | 109.5° |
C7 | C8 | H8A | 109.1° | 109.5° |
H7 | C7 | H7A | 109.5° | 109.5° |
C9 | C8 | H8 | 109.2° | 109.5° |
C9 | C8 | H8A | 109.2° | 109.5° |
C8 | C9 | C10 | 122.2° | 120.0° |
C8 | C9 | H9 | 118.9° | 120.0° |
H8 | C8 | H8A | 109.5° | 109.4° |
C10 | C9 | H9 | 118.9° | 120.0° |
C9 | C10 | C11 | 122.8° | 120.0° |
C9 | C10 | H10 | 118.6° | 120.0° |
C11 | C10 | H10 | 118.6° | 120.0° |
C10 | C11 | C12 | 109.9° | 109.5° |
C10 | C11 | H11 | 109.4° | 109.4° |
C10 | C11 | H11A | 109.3° | 109.5° |
C12 | C11 | H11 | 109.3° | 109.5° |
C12 | C11 | H11A | 109.3° | 109.5° |
C11 | C12 | C13 | 112.2° | 109.5° |
C11 | C12 | H12 | 108.8° | 109.4° |
C11 | C12 | H12A | 108.8° | 109.4° |
H11 | C11 | H11A | 109.5° | 109.4° |
C13 | C12 | H12 | 108.8° | 109.5° |
C13 | C12 | H12A | 108.8° | 109.5° |
C12 | C13 | C14 | 110.2° | 109.5° |
C12 | C13 | H13 | 109.2° | 109.5° |
C12 | C13 | H13A | 109.3° | 109.5° |
H12 | C12 | H12A | 109.5° | 109.5° |
C14 | C13 | H13 | 109.3° | 109.5° |
C14 | C13 | H13A | 109.3° | 109.5° |
C13 | C14 | C15 | 111.4° | 109.5° |
C13 | C14 | H14 | 109.0° | 109.5° |
C13 | C14 | H14A | 109.0° | 109.5° |
H13 | C13 | H13A | 109.5° | 109.4° |
C15 | C14 | H14 | 108.9° | 109.5° |
C15 | C14 | H14A | 109.0° | 109.5° |
C14 | C15 | C16 | 111.0° | 109.5° |
C14 | C15 | H15 | 109.1° | 109.5° |
C14 | C15 | H15A | 109.1° | 109.5° |
H14 | C14 | H14A | 109.5° | 109.4° |
C16 | C15 | H15 | 109.1° | 109.4° |
C16 | C15 | H15A | 109.1° | 109.5° |
C15 | C16 | H16A | 98.2° | 109.4° |
C15 | C16 | H16B | 98.2° | 109.5° |
C15 | C16 | C17 | 151.4° | 109.5° |
H15 | C15 | H15A | 109.5° | 109.5° |
H16A | C16 | H16B | 109.5° | 109.5° |
H16A | C16 | C17 | 98.2° | 109.4° |
H16B | C16 | C17 | 98.2° | 109.5° |
C16 | C17 | C18 | 120.0° | 109.5° |
C16 | C17 | H50 | 106.8° | 109.4° |
C16 | C17 | H51 | 106.8° | 109.5° |
C18 | C17 | H50 | 106.8° | 109.5° |
C18 | C17 | H51 | 106.8° | 109.5° |
C17 | C18 | H52 | 109.5° | 109.4° |
C17 | C18 | H53 | 109.5° | 109.4° |
C17 | C18 | H54 | 109.5° | 109.5° |
H50 | C17 | H51 | 109.5° | 109.4° |
H52 | C18 | H53 | 109.5° | 109.5° |
H52 | C18 | H54 | 109.5° | 109.5° |
H53 | C18 | H54 | 109.5° | 109.5° |
P24 | O28 | HO28 | 90.0° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O23 | P24 | O26 | O27 | 151.2° | 120.0° |
O23 | P24 | O26 | O28 | 19.4° | 120.0° |
O23 | P24 | O27 | O28 | 2.2° | 120.0° |
O23 | P24 | O27 | C28 | 79.3° | 175.0° |
O23 | P24 | O28 | HO28 | 90.0° | 60.0° |
O26 | P24 | O27 | O28 | 153.6° | 120.0° |
O26 | P24 | O27 | C28 | 72.1° | 55.0° |
O26 | P24 | O28 | HO28 | 90.0° | 180.0° |
O26 | P24 | O23 | HO23 | 0.0° | 60.0° |
P24 | O27 | C28 | C29 | 145.3° | 180.0° |
P24 | O27 | C28 | H28 | 94.7° | 60.0° |
P24 | O27 | C28 | H28A | 25.3° | 60.0° |
O27 | P24 | O28 | HO28 | 90.0° | 60.0° |
O27 | P24 | O23 | HO23 | 151.1° | 180.0° |
O27 | C28 | C29 | H28 | 120.0° | 120.0° |
O27 | C28 | C29 | H28A | 120.0° | 120.1° |
O27 | C28 | H28 | H28A | 120.0° | 120.1° |
O27 | C28 | C29 | C31 | 57.4° | 60.0° |
O27 | C28 | C29 | C30 | 175.8° | 60.0° |
O27 | C28 | C29 | C32 | 62.1° | 180.0° |
C28 | O27 | P24 | O28 | 81.5° | 65.0° |
C29 | C28 | H28 | H28A | 119.9° | 119.9° |
C28 | C29 | C31 | C30 | 118.4° | 120.0° |
C28 | C29 | C31 | C32 | 119.4° | 120.0° |
C28 | C29 | C30 | C32 | 120.6° | 120.0° |
C28 | C29 | C31 | H31 | 180.0° | 55.4° |
C28 | C29 | C31 | H31A | 60.0° | 175.3° |
C28 | C29 | C31 | H31B | 60.0° | 64.6° |
C28 | C29 | C30 | H30 | 180.0° | 60.3° |
C28 | C29 | C30 | H30A | 60.0° | 179.7° |
C28 | C29 | C30 | H30B | 60.0° | 59.8° |
C28 | C29 | C32 | O33 | 151.6° | 65.4° |
C28 | C29 | C32 | C34 | 84.9° | 54.6° |
C28 | C29 | C32 | H32 | 32.6° | 174.6° |
H28 | C28 | C29 | C31 | 177.4° | 180.0° |
H28 | C28 | C29 | C30 | 64.2° | 60.0° |
H28 | C28 | C29 | C32 | 57.9° | 60.0° |
H28A | C28 | C29 | C31 | 62.6° | 60.0° |
H28A | C28 | C29 | C30 | 55.7° | 180.0° |
H28A | C28 | C29 | C32 | 177.9° | 60.0° |
C31 | C29 | C30 | C32 | 120.7° | 120.0° |
C29 | C31 | H31 | H31A | 120.0° | 119.9° |
C29 | C31 | H31 | H31B | 120.0° | 120.0° |
C29 | C31 | H31A | H31B | 120.0° | 120.0° |
C31 | C29 | C30 | H30 | 61.4° | 179.7° |
C31 | C29 | C30 | H30A | 178.6° | 59.7° |
C31 | C29 | C30 | H30B | 58.6° | 60.2° |
C31 | C29 | C32 | O33 | 32.3° | 54.6° |
C31 | C29 | C32 | C34 | 155.8° | 174.6° |
C31 | C29 | C32 | H32 | 86.7° | 65.4° |
C30 | C29 | C31 | H31 | 61.5° | 64.6° |
C30 | C29 | C31 | H31A | 58.4° | 55.3° |
C30 | C29 | C31 | H31B | 178.4° | 175.4° |
C29 | C30 | H30 | H30A | 120.0° | 120.0° |
C29 | C30 | H30 | H30B | 120.0° | 120.0° |
C29 | C30 | H30A | H30B | 120.0° | 119.9° |
C30 | C29 | C32 | O33 | 88.0° | 174.6° |
C30 | C29 | C32 | C34 | 35.5° | 65.4° |
C30 | C29 | C32 | H32 | 153.0° | 54.6° |
C32 | C29 | C31 | H31 | 60.6° | 175.4° |
C32 | C29 | C31 | H31A | 179.4° | 64.7° |
C32 | C29 | C31 | H31B | 59.4° | 55.4° |
C32 | C29 | C30 | H30 | 59.4° | 59.7° |
C32 | C29 | C30 | H30A | 60.6° | 60.2° |
C32 | C29 | C30 | H30B | 179.4° | 179.8° |
C29 | C32 | O33 | C34 | 123.5° | 119.9° |
C29 | C32 | O33 | H32 | 118.2° | 120.0° |
C29 | C32 | C34 | H32 | 117.3° | 120.0° |
C29 | C32 | O33 | HO33 | 180.0° | 60.0° |
C29 | C32 | C34 | O35 | 67.1° | 103.9° |
C29 | C32 | C34 | N36 | 112.9° | 76.1° |
H31 | C31 | H31A | H31B | 120.0° | 120.0° |
H30 | C30 | H30A | H30B | 120.0° | 120.1° |
O33 | C32 | C34 | H32 | 118.8° | 120.0° |
O33 | C32 | C34 | O35 | 169.0° | 16.0° |
O33 | C32 | C34 | N36 | 11.0° | 163.9° |
C34 | C32 | O33 | HO33 | 56.5° | 60.0° |
C32 | C34 | O35 | N36 | 180.0° | 180.0° |
C32 | C34 | N36 | C37 | 0.2° | 174.9° |
C32 | C34 | N36 | HN36 | 179.8° | 5.2° |
H32 | C32 | O33 | HO33 | 61.8° | 180.0° |
H32 | C32 | C34 | O35 | 50.2° | 136.1° |
H32 | C32 | C34 | N36 | 129.8° | 43.9° |
O35 | C34 | N36 | C37 | 179.8° | 5.1° |
O35 | C34 | N36 | HN36 | 0.2° | 174.9° |
C34 | N36 | C37 | HN36 | 180.0° | 179.9° |
C34 | N36 | C37 | C38 | 174.1° | 180.0° |
C34 | N36 | C37 | H37 | 54.6° | 59.9° |
C34 | N36 | C37 | H37A | 66.4° | 60.0° |
N36 | C37 | C38 | H37 | 119.5° | 120.1° |
N36 | C37 | C38 | H37A | 119.5° | 120.0° |
N36 | C37 | H37 | H37A | 121.5° | 119.9° |
N36 | C37 | C38 | C39 | 86.5° | 180.0° |
N36 | C37 | C38 | H38 | 153.4° | 60.0° |
N36 | C37 | C38 | H38A | 33.5° | 60.0° |
HN36 | N36 | C37 | C38 | 5.9° | 0.0° |
HN36 | N36 | C37 | H37 | 125.4° | 120.0° |
HN36 | N36 | C37 | H37A | 113.6° | 120.0° |
C38 | C37 | H37 | H37A | 121.5° | 120.0° |
C37 | C38 | C39 | H38 | 120.1° | 120.0° |
C37 | C38 | C39 | H38A | 120.1° | 120.0° |
C37 | C38 | H38 | H38A | 119.7° | 120.0° |
C37 | C38 | C39 | O40 | 54.1° | 0.0° |
C37 | C38 | C39 | N41 | 127.1° | 180.0° |
H37 | C37 | C38 | C39 | 33.0° | 60.0° |
H37 | C37 | C38 | H38 | 87.1° | 180.0° |
H37 | C37 | C38 | H38A | 153.0° | 60.0° |
H37A | C37 | C38 | C39 | 153.9° | 60.0° |
H37A | C37 | C38 | H38 | 33.9° | 60.0° |
H37A | C37 | C38 | H38A | 86.0° | 180.0° |
C39 | C38 | H38 | H38A | 119.8° | 120.0° |
C38 | C39 | O40 | N41 | 178.8° | 180.0° |
C38 | C39 | N41 | C42 | 179.6° | 180.0° |
C38 | C39 | N41 | HN41 | 0.4° | 0.0° |
H38 | C38 | C39 | O40 | 174.1° | 120.0° |
H38 | C38 | C39 | N41 | 7.0° | 60.0° |
H38A | C38 | C39 | O40 | 66.0° | 119.9° |
H38A | C38 | C39 | N41 | 112.8° | 60.1° |
O40 | C39 | N41 | C42 | 0.8° | 0.0° |
O40 | C39 | N41 | HN41 | 179.2° | 180.0° |
C39 | N41 | C42 | HN41 | 180.0° | 180.0° |
C39 | N41 | C42 | C43 | 97.1° | 180.0° |
C39 | N41 | C42 | H42 | 22.3° | 60.0° |
C39 | N41 | C42 | H42A | 143.6° | 60.1° |
N41 | C42 | C43 | H42 | 119.4° | 120.0° |
N41 | C42 | C43 | H42A | 119.3° | 120.0° |
N41 | C42 | H42 | H42A | 121.9° | 120.1° |
N41 | C42 | C43 | S1 | 150.7° | 180.0° |
N41 | C42 | C43 | H43 | 30.7° | 59.9° |
N41 | C42 | C43 | H43A | 89.2° | 60.0° |
HN41 | N41 | C42 | C43 | 82.9° | 0.0° |
HN41 | N41 | C42 | H42 | 157.7° | 119.9° |
HN41 | N41 | C42 | H42A | 36.4° | 120.0° |
C43 | C42 | H42 | H42A | 121.9° | 120.0° |
C42 | C43 | S1 | H43 | 120.1° | 120.1° |
C42 | C43 | S1 | H43A | 120.0° | 120.0° |
C42 | C43 | H43 | H43A | 119.8° | 120.0° |
C42 | C43 | S1 | C1 | 44.5° | 180.0° |
H42 | C42 | C43 | S1 | 89.9° | 60.0° |
H42 | C42 | C43 | H43 | 150.0° | 179.9° |
H42 | C42 | C43 | H43A | 30.1° | 60.0° |
H42A | C42 | C43 | S1 | 31.4° | 60.0° |
H42A | C42 | C43 | H43 | 88.6° | 60.0° |
H42A | C42 | C43 | H43A | 151.5° | 180.0° |
S1 | C43 | H43 | H43A | 119.9° | 119.9° |
C43 | S1 | C1 | O1 | 29.1° | 0.0° |
C43 | S1 | C1 | C2 | 166.8° | 180.0° |
H43 | C43 | S1 | C1 | 164.5° | 60.0° |
H43A | C43 | S1 | C1 | 75.6° | 60.0° |
S1 | C1 | O1 | C2 | 164.1° | 180.0° |
S1 | C1 | C2 | C3 | 41.3° | 180.0° |
S1 | C1 | C2 | H2 | 161.5° | 60.1° |
S1 | C1 | C2 | H2A | 78.9° | 60.0° |
O1 | C1 | C2 | C3 | 122.7° | 0.0° |
O1 | C1 | C2 | H2 | 2.5° | 120.0° |
O1 | C1 | C2 | H2A | 117.1° | 120.0° |
C1 | C2 | C3 | H2 | 120.2° | 120.0° |
C1 | C2 | C3 | H2A | 120.2° | 120.0° |
C1 | C2 | H2 | H2A | 119.4° | 120.1° |
C1 | C2 | C3 | C4 | 165.3° | 180.0° |
C1 | C2 | C3 | H3 | 74.4° | 60.0° |
C1 | C2 | C3 | H3A | 45.0° | 60.0° |
C3 | C2 | H2 | H2A | 119.4° | 119.9° |
C2 | C3 | C4 | H3 | 120.3° | 120.0° |
C2 | C3 | C4 | H3A | 120.3° | 120.0° |
C2 | C3 | H3 | H3A | 119.1° | 120.0° |
C2 | C3 | C4 | C5 | 113.2° | 180.0° |
C2 | C3 | C4 | H4 | 126.6° | 60.0° |
C2 | C3 | C4 | H4A | 7.0° | 60.0° |
H2 | C2 | C3 | C4 | 45.1° | 60.0° |
H2 | C2 | C3 | H3 | 165.4° | 180.0° |
H2 | C2 | C3 | H3A | 75.2° | 60.0° |
H2A | C2 | C3 | C4 | 74.5° | 60.0° |
H2A | C2 | C3 | H3 | 45.7° | 60.0° |
H2A | C2 | C3 | H3A | 165.2° | 180.0° |
C4 | C3 | H3 | H3A | 119.0° | 120.0° |
C3 | C4 | C5 | H4 | 120.2° | 120.0° |
C3 | C4 | C5 | H4A | 120.2° | 120.0° |
C3 | C4 | H4 | H4A | 119.4° | 120.0° |
C3 | C4 | C5 | C6 | 155.3° | 180.0° |
C3 | C4 | C5 | H5 | 84.5° | 60.0° |
C3 | C4 | C5 | H5A | 35.0° | 59.9° |
H3 | C3 | C4 | C5 | 7.1° | 60.0° |
H3 | C3 | C4 | H4 | 113.1° | 180.0° |
H3 | C3 | C4 | H4A | 127.3° | 60.0° |
H3A | C3 | C4 | C5 | 126.5° | 60.0° |
H3A | C3 | C4 | H4 | 6.3° | 60.0° |
H3A | C3 | C4 | H4A | 113.3° | 179.9° |
C5 | C4 | H4 | H4A | 119.5° | 120.1° |
C4 | C5 | C6 | H5 | 120.3° | 120.0° |
C4 | C5 | C6 | H5A | 120.3° | 120.0° |
C4 | C5 | H5 | H5A | 119.2° | 120.0° |
C4 | C5 | C6 | C7 | 105.5° | 180.0° |
C4 | C5 | C6 | H6 | 134.2° | 60.0° |
C4 | C5 | C6 | H6A | 14.8° | 60.0° |
H4 | C4 | C5 | C6 | 35.1° | 60.0° |
H4 | C4 | C5 | H5 | 155.4° | NaN° |
H4 | C4 | C5 | H5A | 85.2° | 60.0° |
H4A | C4 | C5 | C6 | 84.6° | 60.0° |
H4A | C4 | C5 | H5 | 35.7° | 60.0° |
H4A | C4 | C5 | H5A | 155.2° | 179.9° |
C6 | C5 | H5 | H5A | 119.1° | 120.0° |
C5 | C6 | C7 | H6 | 120.3° | 120.0° |
C5 | C6 | C7 | H6A | 120.3° | 120.0° |
C5 | C6 | H6 | H6A | 119.1° | 120.0° |
C5 | C6 | C7 | C8 | 59.0° | 180.0° |
C5 | C6 | C7 | H7 | 179.3° | 60.0° |
C5 | C6 | C7 | H7A | 61.3° | 60.0° |
H5 | C5 | C6 | C7 | 14.8° | 60.0° |
H5 | C5 | C6 | H6 | 105.5° | 180.0° |
H5 | C5 | C6 | H6A | 135.1° | 60.0° |
H5A | C5 | C6 | C7 | 134.2° | 60.0° |
H5A | C5 | C6 | H6 | 13.9° | 60.0° |
H5A | C5 | C6 | H6A | 105.5° | 180.0° |
C7 | C6 | H6 | H6A | 119.1° | 120.0° |
C6 | C7 | C8 | H7 | 120.3° | 120.0° |
C6 | C7 | C8 | H7A | 120.3° | 120.0° |
C6 | C7 | H7 | H7A | 119.0° | 120.0° |
C6 | C7 | C8 | C9 | 174.3° | 180.0° |
C6 | C7 | C8 | H8 | 54.1° | 59.9° |
C6 | C7 | C8 | H8A | 65.5° | 60.0° |
H6 | C6 | C7 | C8 | 61.3° | 60.0° |
H6 | C6 | C7 | H7 | 59.0° | 180.0° |
H6 | C6 | C7 | H7A | 178.4° | 60.0° |
H6A | C6 | C7 | C8 | 179.3° | 60.0° |
H6A | C6 | C7 | H7 | 60.4° | 59.9° |
H6A | C6 | C7 | H7A | 59.0° | 180.0° |
C8 | C7 | H7 | H7A | 119.0° | 119.9° |
C7 | C8 | C9 | H8 | 120.2° | 120.0° |
C7 | C8 | C9 | H8A | 120.2° | 120.0° |
C7 | C8 | H8 | H8A | 119.4° | 120.0° |
C7 | C8 | C9 | C10 | 117.3° | 127.4° |
C7 | C8 | C9 | H9 | 62.7° | 52.6° |
H7 | C7 | C8 | C9 | 65.4° | 60.0° |
H7 | C7 | C8 | H8 | 174.4° | 179.9° |
H7 | C7 | C8 | H8A | 54.8° | 60.0° |
H7A | C7 | C8 | C9 | 53.9° | 60.0° |
H7A | C7 | C8 | H8 | 66.3° | 60.1° |
H7A | C7 | C8 | H8A | 174.1° | 180.0° |
C9 | C8 | H8 | H8A | 119.5° | 120.0° |
C8 | C9 | C10 | H9 | 180.0° | 180.0° |
C8 | C9 | C10 | C11 | 0.0° | 7.1° |
C8 | C9 | C10 | H10 | 180.0° | 172.9° |
H8 | C8 | C9 | C10 | 2.9° | 7.3° |
H8 | C8 | C9 | H9 | 177.1° | 172.6° |
H8A | C8 | C9 | C10 | 122.5° | 112.6° |
H8A | C8 | C9 | H9 | 57.5° | 67.4° |
C9 | C10 | C11 | H10 | 180.0° | 179.9° |
C9 | C10 | C11 | C12 | 168.2° | 127.4° |
C9 | C10 | C11 | H11 | 71.7° | 112.6° |
C9 | C10 | C11 | H11A | 48.1° | 7.3° |
H9 | C9 | C10 | C11 | 179.9° | 172.9° |
H9 | C9 | C10 | H10 | 0.1° | 7.0° |
C10 | C11 | C12 | H11 | 120.1° | 120.0° |
C10 | C11 | C12 | H11A | 120.1° | 120.0° |
C10 | C11 | H11 | H11A | 119.8° | 119.9° |
C10 | C11 | C12 | C13 | 149.8° | 180.0° |
C10 | C11 | C12 | H12 | 89.8° | 60.0° |
C10 | C11 | C12 | H12A | 29.4° | 60.0° |
H10 | C10 | C11 | C12 | 11.8° | 52.6° |
H10 | C10 | C11 | H11 | 108.3° | 67.5° |
H10 | C10 | C11 | H11A | 131.9° | 172.6° |
C12 | C11 | H11 | H11A | 119.8° | 120.0° |
C11 | C12 | C13 | H12 | 120.4° | 120.0° |
C11 | C12 | C13 | H12A | 120.4° | 120.0° |
C11 | C12 | H12 | H12A | 118.7° | 120.0° |
C11 | C12 | C13 | C14 | 152.1° | 180.0° |
C11 | C12 | C13 | H13 | 87.7° | 60.0° |
C11 | C12 | C13 | H13A | 32.0° | 60.0° |
H11 | C11 | C12 | C13 | 29.7° | 60.0° |
H11 | C11 | C12 | H12 | 150.1° | 180.0° |
H11 | C11 | C12 | H12A | 90.7° | 60.0° |
H11A | C11 | C12 | C13 | 90.2° | 60.0° |
H11A | C11 | C12 | H12 | 30.2° | 60.0° |
H11A | C11 | C12 | H12A | 149.4° | 180.0° |
C13 | C12 | H12 | H12A | 118.8° | 120.0° |
C12 | C13 | C14 | H13 | 120.1° | 120.0° |
C12 | C13 | C14 | H13A | 120.1° | 120.0° |
C12 | C13 | H13 | H13A | 119.6° | 120.0° |
C12 | C13 | C14 | C15 | 134.4° | 180.0° |
C12 | C13 | C14 | H14 | 105.3° | 60.0° |
C12 | C13 | C14 | H14A | 14.1° | 60.0° |
H12 | C12 | C13 | C14 | 31.8° | 60.0° |
H12 | C12 | C13 | H13 | 151.9° | 179.9° |
H12 | C12 | C13 | H13A | 88.4° | 60.0° |
H12A | C12 | C13 | C14 | 87.5° | 60.0° |
H12A | C12 | C13 | H13 | 32.7° | 60.0° |
H12A | C12 | C13 | H13A | 152.4° | 180.0° |
C14 | C13 | H13 | H13A | 119.7° | 120.0° |
C13 | C14 | C15 | H14 | 120.3° | 120.0° |
C13 | C14 | C15 | H14A | 120.3° | 120.0° |
C13 | C14 | H14 | H14A | 119.1° | 120.0° |
C13 | C14 | C15 | C16 | 179.0° | 180.0° |
C13 | C14 | C15 | H15 | 58.7° | 60.0° |
C13 | C14 | C15 | H15A | 60.8° | 60.0° |
H13 | C13 | C14 | C15 | 14.3° | 60.0° |
H13 | C13 | C14 | H14 | 134.6° | 180.0° |
H13 | C13 | C14 | H14A | 106.0° | 60.0° |
H13A | C13 | C14 | C15 | 105.5° | 60.0° |
H13A | C13 | C14 | H14 | 14.8° | 60.0° |
H13A | C13 | C14 | H14A | 134.2° | 180.0° |
C15 | C14 | H14 | H14A | 119.1° | 120.0° |
C14 | C15 | C16 | H15 | 120.2° | 120.0° |
C14 | C15 | C16 | H15A | 120.2° | 120.0° |
C14 | C15 | H15 | H15A | 119.3° | 120.0° |
C14 | C15 | C16 | H16A | 89.3° | 60.1° |
C14 | C15 | C16 | H16B | 21.9° | 60.0° |
C14 | C15 | C16 | C17 | 146.3° | 180.0° |
H14 | C14 | C15 | C16 | 60.7° | 60.0° |
H14 | C14 | C15 | H15 | 179.0° | 179.9° |
H14 | C14 | C15 | H15A | 59.5° | 60.0° |
H14A | C14 | C15 | C16 | 58.7° | 59.9° |
H14A | C14 | C15 | H15 | 61.6° | 60.0° |
H14A | C14 | C15 | H15A | 178.9° | 180.0° |
C16 | C15 | H15 | H15A | 119.3° | 120.0° |
C15 | C16 | H16A | H16B | 101.8° | 120.0° |
C15 | C16 | H16A | C17 | 156.5° | 119.9° |
C15 | C16 | H16B | C17 | 156.4° | 120.0° |
C15 | C16 | C17 | C18 | 51.2° | 180.0° |
C15 | C16 | C17 | H50 | 172.7° | 60.0° |
C15 | C16 | C17 | H51 | 70.3° | 59.9° |
H15 | C15 | C16 | H16A | 150.4° | 180.0° |
H15 | C15 | C16 | H16B | 98.4° | 60.0° |
H15 | C15 | C16 | C17 | 26.0° | 60.1° |
H15A | C15 | C16 | H16A | 30.9° | 59.9° |
H15A | C15 | C16 | H16B | 142.1° | 180.0° |
H15A | C15 | C16 | C17 | 93.5° | 60.0° |
H16A | C16 | H16B | C17 | 101.8° | 120.0° |
H16A | C16 | C17 | C18 | 73.2° | 60.1° |
H16A | C16 | C17 | H50 | 48.3° | 179.9° |
H16A | C16 | C17 | H51 | 165.3° | 60.0° |
H16B | C16 | C17 | C18 | 175.6° | 60.0° |
H16B | C16 | C17 | H50 | 62.9° | 60.0° |
H16B | C16 | C17 | H51 | 54.1° | NaN° |
C16 | C17 | C18 | H50 | 121.5° | 120.0° |
C16 | C17 | C18 | H51 | 121.5° | 120.0° |
C16 | C17 | H50 | H51 | 115.2° | 120.0° |
C16 | C17 | C18 | H52 | 180.0° | 60.0° |
C16 | C17 | C18 | H53 | 60.0° | 60.0° |
C16 | C17 | C18 | H54 | 60.0° | 180.0° |
C18 | C17 | H50 | H51 | 115.3° | 120.0° |
C17 | C18 | H52 | H53 | 120.0° | 120.0° |
C17 | C18 | H52 | H54 | 120.0° | 120.0° |
C17 | C18 | H53 | H54 | 120.0° | 120.0° |
H50 | C17 | C18 | H52 | 58.5° | 180.0° |
H50 | C17 | C18 | H53 | 178.5° | 60.0° |
H50 | C17 | C18 | H54 | 61.5° | 60.0° |
H51 | C17 | C18 | H52 | 58.5° | 60.0° |
H51 | C17 | C18 | H53 | 61.5° | 180.0° |
H51 | C17 | C18 | H54 | 178.5° | 60.0° |
H52 | C18 | H53 | H54 | 120.0° | 120.0° |
O28 | P24 | O23 | HO23 | 155.7° | 60.0° |