XPA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | P1 | sing | 1.54Å | 1.53Å | |
O2 | P1 | doub | 1.55Å | 1.53Å | |
P1 | O3 | sing | 1.61Å | 1.53Å | |
P1 | O4 | sing | 1.61Å | 1.54Å | |
O3 | H1 | sing | 0.97Å | 1.11Å | |
O4 | C1 | sing | 1.43Å | 1.46Å | |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C1 | H2 | sing | 1.09Å | 1.11Å | |
C1 | H3 | sing | 1.09Å | 1.11Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
C2 | O7 | sing | 1.45Å | 1.47Å | |
C2 | H4 | sing | 1.09Å | 1.10Å | |
C3 | O5 | sing | 1.45Å | 1.45Å | |
C3 | H5 | sing | 1.09Å | 1.11Å | |
C3 | H6 | sing | 1.09Å | 1.11Å | |
O5 | C4 | sing | 1.34Å | 1.45Å | |
C4 | O6 | doub | 1.21Å | 1.25Å | |
C4 | C5 | sing | 1.51Å | 1.53Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | H7 | sing | 1.09Å | 1.11Å | |
C5 | H8 | sing | 1.09Å | 1.11Å | |
C6 | C7 | sing | 1.53Å | 1.52Å | |
C6 | H9 | sing | 1.09Å | 1.11Å | |
C6 | H10 | sing | 1.09Å | 1.11Å | |
C7 | C8 | sing | 1.53Å | 1.50Å | |
C7 | H11 | sing | 1.09Å | 1.11Å | |
C7 | H12 | sing | 1.09Å | 1.11Å | |
C8 | C9 | sing | 1.53Å | 1.51Å | |
C8 | H13 | sing | 1.09Å | 1.11Å | |
C8 | H14 | sing | 1.09Å | 1.11Å | |
C9 | C10 | sing | 1.53Å | 1.52Å | |
C9 | H15 | sing | 1.09Å | 1.11Å | |
C9 | H16 | sing | 1.09Å | 1.11Å | |
C10 | C11 | sing | 1.53Å | 1.53Å | |
C10 | H17 | sing | 1.09Å | 1.11Å | |
C10 | H18 | sing | 1.09Å | 1.11Å | |
C11 | C12 | sing | 1.53Å | 1.52Å | |
C11 | H19 | sing | 1.09Å | 1.11Å | |
C11 | H20 | sing | 1.09Å | 1.11Å | |
C12 | C13 | sing | 1.53Å | 1.51Å | |
C12 | H21 | sing | 1.09Å | 1.11Å | |
C12 | H22 | sing | 1.09Å | 1.11Å | |
C13 | H23 | sing | 1.09Å | 1.11Å | |
C13 | H24 | sing | 1.09Å | 1.11Å | |
C13 | H25 | sing | 1.09Å | 1.11Å | |
O7 | C14 | sing | 1.34Å | 1.48Å | |
C14 | O8 | doub | 1.21Å | 1.25Å | |
C14 | C15 | sing | 1.51Å | 1.52Å | |
C15 | C16 | sing | 1.53Å | 1.53Å | |
C15 | H26 | sing | 1.09Å | 1.11Å | |
C15 | H27 | sing | 1.09Å | 1.11Å | |
C16 | C17 | sing | 1.53Å | 1.53Å | |
C16 | H28 | sing | 1.09Å | 1.11Å | |
C16 | H29 | sing | 1.09Å | 1.11Å | |
C17 | C18 | sing | 1.53Å | 1.53Å | |
C17 | H30 | sing | 1.09Å | 1.11Å | |
C17 | H31 | sing | 1.09Å | 1.11Å | |
C18 | C19 | sing | 1.53Å | 1.53Å | |
C18 | H32 | sing | 1.09Å | 1.11Å | |
C18 | H33 | sing | 1.09Å | 1.11Å | |
C19 | C20 | sing | 1.53Å | 1.52Å | |
C19 | H34 | sing | 1.09Å | 1.11Å | |
C19 | H35 | sing | 1.09Å | 1.11Å | |
C20 | C21 | sing | 1.53Å | 1.51Å | |
C20 | H36 | sing | 1.09Å | 1.11Å | |
C20 | H37 | sing | 1.09Å | 1.11Å | |
C21 | C22 | sing | 1.53Å | 1.51Å | |
C21 | H38 | sing | 1.09Å | 1.11Å | |
C21 | H39 | sing | 1.09Å | 1.11Å | |
C22 | C23 | sing | 1.53Å | 1.52Å | |
C22 | H40 | sing | 1.09Å | 1.11Å | |
C22 | H41 | sing | 1.09Å | 1.11Å | |
C23 | H42 | sing | 1.09Å | 1.11Å | |
C23 | H43 | sing | 1.09Å | 1.11Å | |
C23 | H44 | sing | 1.09Å | 1.11Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | P1 | O2 | 109.1° | 109.5° |
O1 | P1 | O3 | 109.3° | 109.4° |
O1 | P1 | O4 | 109.9° | 109.5° |
O2 | P1 | O3 | 109.2° | 109.5° |
O2 | P1 | O4 | 109.7° | 109.5° |
O3 | P1 | O4 | 109.7° | 109.5° |
P1 | O3 | H1 | 110.0° | 106.7° |
P1 | O4 | C1 | 110.9° | 106.8° |
O4 | C1 | C2 | 109.5° | 109.4° |
O4 | C1 | H2 | 109.4° | 109.5° |
O4 | C1 | H3 | 109.4° | 109.4° |
C2 | C1 | H2 | 111.7° | 109.5° |
C2 | C1 | H3 | 111.6° | 109.5° |
C1 | C2 | C3 | 111.8° | 109.5° |
C1 | C2 | O7 | 109.8° | 109.5° |
C1 | C2 | H4 | 110.6° | 109.5° |
H2 | C1 | H3 | 105.1° | 109.5° |
C3 | C2 | O7 | 114.1° | 109.5° |
C3 | C2 | H4 | 105.7° | 109.5° |
C2 | C3 | O5 | 108.3° | 109.5° |
C2 | C3 | H5 | 112.1° | 109.5° |
C2 | C3 | H6 | 112.0° | 109.5° |
O7 | C2 | H4 | 104.5° | 109.4° |
C2 | O7 | C14 | 119.2° | 120.0° |
O5 | C3 | H5 | 109.8° | 109.4° |
O5 | C3 | H6 | 109.7° | 109.5° |
C3 | O5 | C4 | 113.0° | 120.0° |
H5 | C3 | H6 | 105.0° | 109.5° |
O5 | C4 | O6 | 121.7° | 120.0° |
O5 | C4 | C5 | 115.4° | 120.0° |
O6 | C4 | C5 | 122.9° | 120.0° |
C4 | C5 | C6 | 115.2° | 109.5° |
C4 | C5 | H7 | 109.1° | 109.5° |
C4 | C5 | H8 | 109.1° | 109.5° |
C6 | C5 | H7 | 108.9° | 109.4° |
C6 | C5 | H8 | 109.0° | 109.5° |
C5 | C6 | C7 | 112.1° | 109.5° |
C5 | C6 | H9 | 110.0° | 109.5° |
C5 | C6 | H10 | 110.1° | 109.4° |
H7 | C5 | H8 | 105.0° | 109.4° |
C7 | C6 | H9 | 109.7° | 109.5° |
C7 | C6 | H10 | 109.8° | 109.5° |
C6 | C7 | C8 | 112.0° | 109.5° |
C6 | C7 | H11 | 110.1° | 109.5° |
C6 | C7 | H12 | 110.2° | 109.5° |
H9 | C6 | H10 | 105.0° | 109.5° |
C8 | C7 | H11 | 109.6° | 109.4° |
C8 | C7 | H12 | 109.7° | 109.5° |
C7 | C8 | C9 | 111.1° | 109.5° |
C7 | C8 | H13 | 110.0° | 109.4° |
C7 | C8 | H14 | 109.9° | 109.5° |
H11 | C7 | H12 | 105.0° | 109.5° |
C9 | C8 | H13 | 110.4° | 109.4° |
C9 | C8 | H14 | 110.3° | 109.5° |
C8 | C9 | C10 | 111.0° | 109.5° |
C8 | C9 | H15 | 110.1° | 109.4° |
C8 | C9 | H16 | 110.1° | 109.5° |
H13 | C8 | H14 | 105.0° | 109.5° |
C10 | C9 | H15 | 110.2° | 109.5° |
C10 | C9 | H16 | 110.2° | 109.5° |
C9 | C10 | C11 | 111.7° | 109.5° |
C9 | C10 | H17 | 109.9° | 109.5° |
C9 | C10 | H18 | 109.9° | 109.5° |
H15 | C9 | H16 | 105.1° | 109.5° |
C11 | C10 | H17 | 110.1° | 109.5° |
C11 | C10 | H18 | 110.0° | 109.4° |
C10 | C11 | C12 | 111.8° | 109.4° |
C10 | C11 | H19 | 110.0° | 109.5° |
C10 | C11 | H20 | 110.1° | 109.5° |
H17 | C10 | H18 | 105.0° | 109.5° |
C12 | C11 | H19 | 109.9° | 109.5° |
C12 | C11 | H20 | 110.0° | 109.4° |
C11 | C12 | C13 | 111.3° | 109.4° |
C11 | C12 | H21 | 110.3° | 109.5° |
C11 | C12 | H22 | 110.2° | 109.5° |
H19 | C11 | H20 | 104.9° | 109.5° |
C13 | C12 | H21 | 110.0° | 109.5° |
C13 | C12 | H22 | 110.0° | 109.5° |
C12 | C13 | H23 | 109.9° | 109.5° |
C12 | C13 | H24 | 110.0° | 109.5° |
C12 | C13 | H25 | 110.0° | 109.5° |
H21 | C12 | H22 | 104.9° | 109.5° |
H23 | C13 | H24 | 108.9° | 109.4° |
H23 | C13 | H25 | 109.0° | 109.5° |
H24 | C13 | H25 | 109.0° | 109.5° |
O7 | C14 | O8 | 121.4° | 119.9° |
O7 | C14 | C15 | 117.8° | 120.0° |
O8 | C14 | C15 | 120.7° | 120.0° |
C14 | C15 | C16 | 112.9° | 109.5° |
C14 | C15 | H26 | 109.4° | 109.5° |
C14 | C15 | H27 | 109.5° | 109.4° |
C16 | C15 | H26 | 109.9° | 109.5° |
C16 | C15 | H27 | 109.9° | 109.4° |
C15 | C16 | C17 | 112.3° | 109.5° |
C15 | C16 | H28 | 109.8° | 109.5° |
C15 | C16 | H29 | 109.9° | 109.4° |
H26 | C15 | H27 | 105.0° | 109.5° |
C17 | C16 | H28 | 109.8° | 109.5° |
C17 | C16 | H29 | 109.8° | 109.5° |
C16 | C17 | C18 | 112.1° | 109.5° |
C16 | C17 | H30 | 110.0° | 109.4° |
C16 | C17 | H31 | 109.9° | 109.5° |
H28 | C16 | H29 | 105.0° | 109.4° |
C18 | C17 | H30 | 109.8° | 109.5° |
C18 | C17 | H31 | 109.9° | 109.5° |
C17 | C18 | C19 | 111.9° | 109.5° |
C17 | C18 | H32 | 109.9° | 109.5° |
C17 | C18 | H33 | 109.9° | 109.5° |
H30 | C17 | H31 | 105.0° | 109.5° |
C19 | C18 | H32 | 109.9° | 109.4° |
C19 | C18 | H33 | 109.9° | 109.5° |
C18 | C19 | C20 | 111.5° | 109.5° |
C18 | C19 | H34 | 110.1° | 109.4° |
C18 | C19 | H35 | 110.1° | 109.4° |
H32 | C18 | H33 | 105.0° | 109.4° |
C20 | C19 | H34 | 110.0° | 109.5° |
C20 | C19 | H35 | 110.0° | 109.5° |
C19 | C20 | C21 | 111.2° | 109.5° |
C19 | C20 | H36 | 110.3° | 109.5° |
C19 | C20 | H37 | 110.3° | 109.4° |
H34 | C19 | H35 | 105.0° | 109.5° |
C21 | C20 | H36 | 110.0° | 109.5° |
C21 | C20 | H37 | 110.0° | 109.5° |
C20 | C21 | C22 | 111.2° | 109.5° |
C20 | C21 | H38 | 110.1° | 109.4° |
C20 | C21 | H39 | 110.0° | 109.5° |
H36 | C20 | H37 | 105.1° | 109.4° |
C22 | C21 | H38 | 110.2° | 109.5° |
C22 | C21 | H39 | 110.2° | 109.5° |
C21 | C22 | C23 | 111.3° | 109.5° |
C21 | C22 | H40 | 109.9° | 109.5° |
C21 | C22 | H41 | 109.9° | 109.5° |
H38 | C21 | H39 | 105.0° | 109.5° |
C23 | C22 | H40 | 110.2° | 109.5° |
C23 | C22 | H41 | 110.2° | 109.5° |
C22 | C23 | H42 | 110.0° | 109.5° |
C22 | C23 | H43 | 110.0° | 109.4° |
C22 | C23 | H44 | 110.0° | 109.5° |
H40 | C22 | H41 | 105.0° | 109.4° |
H42 | C23 | H43 | 108.9° | 109.5° |
H42 | C23 | H44 | 108.9° | 109.5° |
H43 | C23 | H44 | 109.0° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | P1 | O2 | O3 | 119.4° | 120.0° |
O1 | P1 | O2 | O4 | 120.4° | 120.0° |
O1 | P1 | O3 | O4 | 120.5° | 120.0° |
O1 | P1 | O3 | H1 | 131.7° | 60.0° |
O1 | P1 | O4 | C1 | 176.7° | 55.0° |
O2 | P1 | O3 | O4 | 120.2° | 120.0° |
O2 | P1 | O3 | H1 | 109.0° | 60.0° |
O2 | P1 | O4 | C1 | 56.8° | 65.0° |
O3 | P1 | O4 | C1 | 63.1° | 175.0° |
O4 | P1 | O3 | H1 | 11.2° | 180.0° |
P1 | O4 | C1 | C2 | 120.0° | 180.0° |
P1 | O4 | C1 | H2 | 2.7° | 60.0° |
P1 | O4 | C1 | H3 | 117.3° | 60.1° |
O4 | C1 | C2 | H2 | 121.4° | 120.0° |
O4 | C1 | C2 | H3 | 121.3° | 119.9° |
O4 | C1 | H2 | H3 | 117.4° | 120.0° |
O4 | C1 | C2 | C3 | 166.3° | 55.0° |
O4 | C1 | C2 | O7 | 66.0° | 65.0° |
O4 | C1 | C2 | H4 | 48.8° | 175.1° |
C2 | C1 | H2 | H3 | 121.2° | 120.1° |
C1 | C2 | C3 | O7 | 125.3° | 120.0° |
C1 | C2 | C3 | H4 | 120.4° | 120.0° |
C1 | C2 | O7 | H4 | 118.6° | 119.9° |
C1 | C2 | C3 | O5 | 19.4° | 55.0° |
C1 | C2 | C3 | H5 | 101.8° | 65.0° |
C1 | C2 | C3 | H6 | 140.5° | 175.0° |
C1 | C2 | O7 | C14 | 64.6° | 90.0° |
H2 | C1 | C2 | C3 | 44.9° | 65.0° |
H2 | C1 | C2 | O7 | 172.6° | 175.0° |
H2 | C1 | C2 | H4 | 72.6° | 55.1° |
H3 | C1 | C2 | C3 | 72.4° | 174.9° |
H3 | C1 | C2 | O7 | 55.3° | 54.9° |
H3 | C1 | C2 | H4 | 170.1° | 65.0° |
C3 | C2 | O7 | H4 | 115.0° | 120.0° |
C2 | C3 | O5 | H5 | 122.6° | 120.0° |
C2 | C3 | O5 | H6 | 122.5° | 120.1° |
C2 | C3 | H5 | H6 | 121.8° | 120.0° |
C2 | C3 | O5 | C4 | 170.8° | 180.0° |
C3 | C2 | O7 | C14 | 61.8° | 150.0° |
O7 | C2 | C3 | O5 | 105.9° | 65.0° |
O7 | C2 | C3 | H5 | 132.8° | 175.0° |
O7 | C2 | C3 | H6 | 15.1° | 55.0° |
C2 | O7 | C14 | O8 | 179.3° | 0.0° |
C2 | O7 | C14 | C15 | 2.2° | 179.9° |
H4 | C2 | C3 | O5 | 139.8° | 175.0° |
H4 | C2 | C3 | H5 | 18.6° | 55.1° |
H4 | C2 | C3 | H6 | 99.1° | 65.0° |
H4 | C2 | O7 | C14 | 176.8° | 30.0° |
O5 | C3 | H5 | H6 | 117.9° | 120.0° |
C3 | O5 | C4 | O6 | 162.1° | 0.1° |
C3 | O5 | C4 | C5 | 17.6° | 180.0° |
H5 | C3 | O5 | C4 | 48.2° | 60.0° |
H6 | C3 | O5 | C4 | 66.7° | 59.9° |
O5 | C4 | O6 | C5 | 179.7° | 179.9° |
O5 | C4 | C5 | C6 | 178.6° | 180.0° |
O5 | C4 | C5 | H7 | 55.7° | 60.1° |
O5 | C4 | C5 | H8 | 58.4° | 59.9° |
O6 | C4 | C5 | C6 | 1.7° | 0.1° |
O6 | C4 | C5 | H7 | 124.6° | 120.0° |
O6 | C4 | C5 | H8 | 121.3° | 120.0° |
C4 | C5 | C6 | H7 | 123.0° | 120.0° |
C4 | C5 | C6 | H8 | 123.0° | 120.1° |
C4 | C5 | H7 | H8 | 116.8° | 120.0° |
C4 | C5 | C6 | C7 | 42.5° | 180.0° |
C4 | C5 | C6 | H9 | 164.8° | 60.0° |
C4 | C5 | C6 | H10 | 80.0° | 60.0° |
C6 | C5 | H7 | H8 | 116.7° | 120.0° |
C5 | C6 | C7 | H9 | 122.5° | 120.0° |
C5 | C6 | C7 | H10 | 122.7° | 120.0° |
C5 | C6 | H9 | H10 | 118.4° | 120.0° |
C5 | C6 | C7 | C8 | 65.2° | 180.0° |
C5 | C6 | C7 | H11 | 57.0° | 60.0° |
C5 | C6 | C7 | H12 | 172.4° | 60.0° |
H7 | C5 | C6 | C7 | 165.5° | 60.0° |
H7 | C5 | C6 | H9 | 72.3° | 60.0° |
H7 | C5 | C6 | H10 | 43.0° | 180.0° |
H8 | C5 | C6 | C7 | 80.5° | 59.9° |
H8 | C5 | C6 | H9 | 41.8° | 180.0° |
H8 | C5 | C6 | H10 | 157.0° | 60.1° |
C7 | C6 | H9 | H10 | 117.9° | 120.0° |
C6 | C7 | C8 | H11 | 122.5° | 120.0° |
C6 | C7 | C8 | H12 | 122.7° | 120.0° |
C6 | C7 | H11 | H12 | 118.6° | 120.0° |
C6 | C7 | C8 | C9 | 155.9° | 180.0° |
C6 | C7 | C8 | H13 | 81.6° | 60.1° |
C6 | C7 | C8 | H14 | 33.5° | 59.9° |
H9 | C6 | C7 | C8 | 57.3° | 60.0° |
H9 | C6 | C7 | H11 | 179.5° | 60.0° |
H9 | C6 | C7 | H12 | 65.1° | 180.0° |
H10 | C6 | C7 | C8 | 172.1° | 60.0° |
H10 | C6 | C7 | H11 | 65.7° | 180.0° |
H10 | C6 | C7 | H12 | 49.7° | 60.0° |
C8 | C7 | H11 | H12 | 117.8° | 120.0° |
C7 | C8 | C9 | H13 | 122.3° | 120.0° |
C7 | C8 | C9 | H14 | 122.2° | 120.1° |
C7 | C8 | H13 | H14 | 118.2° | 120.0° |
C7 | C8 | C9 | C10 | 127.4° | 180.0° |
C7 | C8 | C9 | H15 | 110.2° | 60.0° |
C7 | C8 | C9 | H16 | 5.1° | 59.9° |
H11 | C7 | C8 | C9 | 81.6° | 60.0° |
H11 | C7 | C8 | H13 | 40.9° | 180.0° |
H11 | C7 | C8 | H14 | 156.1° | 60.1° |
H12 | C7 | C8 | C9 | 33.2° | 60.0° |
H12 | C7 | C8 | H13 | 155.7° | 60.0° |
H12 | C7 | C8 | H14 | 89.2° | 180.0° |
C9 | C8 | H13 | H14 | 118.8° | 120.0° |
C8 | C9 | C10 | H15 | 122.2° | 120.0° |
C8 | C9 | C10 | H16 | 122.3° | 120.0° |
C8 | C9 | H15 | H16 | 118.5° | 119.9° |
C8 | C9 | C10 | C11 | 71.3° | 180.0° |
C8 | C9 | C10 | H17 | 166.3° | 60.0° |
C8 | C9 | C10 | H18 | 51.1° | 60.0° |
H13 | C8 | C9 | C10 | 110.2° | 60.0° |
H13 | C8 | C9 | H15 | 12.1° | 180.0° |
H13 | C8 | C9 | H16 | 127.5° | 60.0° |
H14 | C8 | C9 | C10 | 5.3° | 59.9° |
H14 | C8 | C9 | H15 | 127.6° | 60.1° |
H14 | C8 | C9 | H16 | 117.0° | 180.0° |
C10 | C9 | H15 | H16 | 118.7° | 120.0° |
C9 | C10 | C11 | H17 | 122.4° | 120.0° |
C9 | C10 | C11 | H18 | 122.3° | 120.0° |
C9 | C10 | H17 | H18 | 118.2° | 120.0° |
C9 | C10 | C11 | C12 | 114.0° | 180.0° |
C9 | C10 | C11 | H19 | 8.4° | 60.0° |
C9 | C10 | C11 | H20 | 123.5° | 60.1° |
H15 | C9 | C10 | C11 | 166.5° | 60.0° |
H15 | C9 | C10 | H17 | 44.0° | 180.0° |
H15 | C9 | C10 | H18 | 71.1° | 59.9° |
H16 | C9 | C10 | C11 | 51.0° | 60.0° |
H16 | C9 | C10 | H17 | 71.5° | 60.0° |
H16 | C9 | C10 | H18 | 173.4° | 180.0° |
C11 | C10 | H17 | H18 | 118.3° | 120.0° |
C10 | C11 | C12 | H19 | 122.5° | 120.0° |
C10 | C11 | C12 | H20 | 122.5° | 119.9° |
C10 | C11 | H19 | H20 | 118.3° | 120.0° |
C10 | C11 | C12 | C13 | 83.0° | 180.0° |
C10 | C11 | C12 | H21 | 154.6° | 60.0° |
C10 | C11 | C12 | H22 | 39.3° | 60.0° |
H17 | C10 | C11 | C12 | 8.4° | 60.0° |
H17 | C10 | C11 | H19 | 130.8° | 180.0° |
H17 | C10 | C11 | H20 | 114.1° | 59.9° |
H18 | C10 | C11 | C12 | 123.6° | 60.0° |
H18 | C10 | C11 | H19 | 114.0° | 60.0° |
H18 | C10 | C11 | H20 | 1.2° | 180.0° |
C12 | C11 | H19 | H20 | 118.2° | 120.0° |
C11 | C12 | C13 | H21 | 122.5° | 120.0° |
C11 | C12 | C13 | H22 | 122.4° | 120.0° |
C11 | C12 | H21 | H22 | 118.7° | 120.0° |
C11 | C12 | C13 | H23 | 42.7° | 60.0° |
C11 | C12 | C13 | H24 | 162.7° | 180.0° |
C11 | C12 | C13 | H25 | 77.3° | 60.0° |
H19 | C11 | C12 | C13 | 154.5° | 60.0° |
H19 | C11 | C12 | H21 | 32.1° | 180.0° |
H19 | C11 | C12 | H22 | 83.2° | 60.0° |
H20 | C11 | C12 | C13 | 39.5° | 60.0° |
H20 | C11 | C12 | H21 | 82.9° | 60.0° |
H20 | C11 | C12 | H22 | 161.8° | 180.0° |
C13 | C12 | H21 | H22 | 118.2° | 120.0° |
C12 | C13 | H23 | H24 | 120.6° | 120.0° |
C12 | C13 | H23 | H25 | 120.6° | 120.0° |
C12 | C13 | H24 | H25 | 120.6° | 120.0° |
H21 | C12 | C13 | H23 | 79.8° | 180.0° |
H21 | C12 | C13 | H24 | 40.2° | 60.0° |
H21 | C12 | C13 | H25 | 160.2° | 60.0° |
H22 | C12 | C13 | H23 | 165.2° | 60.0° |
H22 | C12 | C13 | H24 | 74.9° | 60.0° |
H22 | C12 | C13 | H25 | 45.1° | 180.0° |
H23 | C13 | H24 | H25 | 118.8° | 120.0° |
O7 | C14 | O8 | C15 | 178.5° | 180.0° |
O7 | C14 | C15 | C16 | 147.7° | 180.0° |
O7 | C14 | C15 | H26 | 25.0° | 60.0° |
O7 | C14 | C15 | H27 | 89.6° | 60.0° |
O8 | C14 | C15 | C16 | 30.9° | 0.1° |
O8 | C14 | C15 | H26 | 153.6° | 120.0° |
O8 | C14 | C15 | H27 | 91.9° | 120.0° |
C14 | C15 | C16 | H26 | 122.4° | 120.1° |
C14 | C15 | C16 | H27 | 122.5° | 119.9° |
C14 | C15 | H26 | H27 | 117.4° | 120.0° |
C14 | C15 | C16 | C17 | 94.1° | 180.0° |
C14 | C15 | C16 | H28 | 143.5° | 59.9° |
C14 | C15 | C16 | H29 | 28.4° | 60.0° |
C16 | C15 | H26 | H27 | 118.1° | 120.0° |
C15 | C16 | C17 | H28 | 122.5° | 120.1° |
C15 | C16 | C17 | H29 | 122.5° | 120.0° |
C15 | C16 | H28 | H29 | 118.2° | 119.9° |
C15 | C16 | C17 | C18 | 109.8° | 180.0° |
C15 | C16 | C17 | H30 | 12.7° | 60.0° |
C15 | C16 | C17 | H31 | 127.8° | 60.0° |
H26 | C15 | C16 | C17 | 143.5° | 60.0° |
H26 | C15 | C16 | H28 | 21.1° | 180.0° |
H26 | C15 | C16 | H29 | 94.0° | 60.1° |
H27 | C15 | C16 | C17 | 28.4° | 60.0° |
H27 | C15 | C16 | H28 | 94.0° | 60.0° |
H27 | C15 | C16 | H29 | 150.9° | 179.9° |
C17 | C16 | H28 | H29 | 118.0° | 120.0° |
C16 | C17 | C18 | H30 | 122.6° | 119.9° |
C16 | C17 | C18 | H31 | 122.5° | 120.0° |
C16 | C17 | H30 | H31 | 118.2° | 120.0° |
C16 | C17 | C18 | C19 | 77.4° | 180.0° |
C16 | C17 | C18 | H32 | 45.1° | 60.0° |
C16 | C17 | C18 | H33 | 160.2° | 60.0° |
H28 | C16 | C17 | C18 | 12.7° | 60.0° |
H28 | C16 | C17 | H30 | 135.2° | 180.0° |
H28 | C16 | C17 | H31 | 109.7° | 60.0° |
H29 | C16 | C17 | C18 | 127.7° | 60.0° |
H29 | C16 | C17 | H30 | 109.9° | 60.0° |
H29 | C16 | C17 | H31 | 5.2° | 180.0° |
C18 | C17 | H30 | H31 | 118.0° | 120.0° |
C17 | C18 | C19 | H32 | 122.5° | 120.0° |
C17 | C18 | C19 | H33 | 122.4° | 120.1° |
C17 | C18 | H32 | H33 | 118.2° | 120.1° |
C17 | C18 | C19 | C20 | 143.6° | 180.0° |
C17 | C18 | C19 | H34 | 94.0° | 60.0° |
C17 | C18 | C19 | H35 | 21.2° | 60.0° |
H30 | C17 | C18 | C19 | 45.2° | 60.1° |
H30 | C17 | C18 | H32 | 167.6° | 180.0° |
H30 | C17 | C18 | H33 | 77.3° | 60.0° |
H31 | C17 | C18 | C19 | 160.1° | 60.0° |
H31 | C17 | C18 | H32 | 77.4° | 60.0° |
H31 | C17 | C18 | H33 | 37.7° | 180.0° |
C19 | C18 | H32 | H33 | 118.2° | 119.9° |
C18 | C19 | C20 | H34 | 122.5° | 120.0° |
C18 | C19 | C20 | H35 | 122.4° | 120.0° |
C18 | C19 | H34 | H35 | 118.5° | 119.9° |
C18 | C19 | C20 | C21 | 139.3° | 180.0° |
C18 | C19 | C20 | H36 | 17.1° | 60.0° |
C18 | C19 | C20 | H37 | 98.5° | 60.0° |
H32 | C18 | C19 | C20 | 93.9° | 60.0° |
H32 | C18 | C19 | H34 | 28.4° | 180.0° |
H32 | C18 | C19 | H35 | 143.7° | 60.0° |
H33 | C18 | C19 | C20 | 21.2° | 59.9° |
H33 | C18 | C19 | H34 | 143.5° | 60.1° |
H33 | C18 | C19 | H35 | 101.2° | 179.9° |
C20 | C19 | H34 | H35 | 118.3° | 120.0° |
C19 | C20 | C21 | H36 | 122.4° | 120.1° |
C19 | C20 | C21 | H37 | 122.4° | 120.0° |
C19 | C20 | H36 | H37 | 118.8° | 119.9° |
C19 | C20 | C21 | C22 | 123.3° | 180.0° |
C19 | C20 | C21 | H38 | 0.8° | 60.0° |
C19 | C20 | C21 | H39 | 114.4° | 60.0° |
H34 | C19 | C20 | C21 | 16.9° | 60.0° |
H34 | C19 | C20 | H36 | 105.3° | 180.0° |
H34 | C19 | C20 | H37 | 139.1° | 60.1° |
H35 | C19 | C20 | C21 | 98.2° | 60.0° |
H35 | C19 | C20 | H36 | 139.6° | 60.0° |
H35 | C19 | C20 | H37 | 24.0° | 179.9° |
C21 | C20 | H36 | H37 | 118.3° | 120.0° |
C20 | C21 | C22 | H38 | 122.4° | 119.9° |
C20 | C21 | C22 | H39 | 122.3° | 120.0° |
C20 | C21 | H38 | H39 | 118.4° | 120.0° |
C20 | C21 | C22 | C23 | 173.1° | 180.0° |
C20 | C21 | C22 | H40 | 64.5° | 60.0° |
C20 | C21 | C22 | H41 | 50.7° | 59.9° |
H36 | C20 | C21 | C22 | 0.9° | 60.0° |
H36 | C20 | C21 | H38 | 121.5° | 180.0° |
H36 | C20 | C21 | H39 | 123.2° | 60.0° |
H37 | C20 | C21 | C22 | 114.3° | 60.0° |
H37 | C20 | C21 | H38 | 123.2° | 60.0° |
H37 | C20 | C21 | H39 | 8.0° | 180.0° |
C22 | C21 | H38 | H39 | 118.6° | 120.0° |
C21 | C22 | C23 | H40 | 122.3° | 120.0° |
C21 | C22 | C23 | H41 | 122.3° | 120.0° |
C21 | C22 | H40 | H41 | 118.2° | 120.0° |
C21 | C22 | C23 | H42 | 111.5° | 60.0° |
C21 | C22 | C23 | H43 | 8.5° | 180.0° |
C21 | C22 | C23 | H44 | 128.5° | 60.1° |
H38 | C21 | C22 | C23 | 64.5° | 60.1° |
H38 | C21 | C22 | H40 | 57.9° | 179.9° |
H38 | C21 | C22 | H41 | 173.1° | 60.0° |
H39 | C21 | C22 | C23 | 50.8° | 60.0° |
H39 | C21 | C22 | H40 | 173.3° | 60.0° |
H39 | C21 | C22 | H41 | 71.6° | 180.0° |
C23 | C22 | H40 | H41 | 118.7° | 120.0° |
C22 | C23 | H42 | H43 | 120.6° | 120.0° |
C22 | C23 | H42 | H44 | 120.6° | 120.0° |
C22 | C23 | H43 | H44 | 120.7° | 119.9° |
H40 | C22 | C23 | H42 | 126.2° | 60.0° |
H40 | C22 | C23 | H43 | 113.8° | 60.0° |
H40 | C22 | C23 | H44 | 6.2° | 179.9° |
H41 | C22 | C23 | H42 | 10.8° | 180.0° |
H41 | C22 | C23 | H43 | 130.7° | 60.0° |
H41 | C22 | C23 | H44 | 109.2° | 60.0° |
H42 | C23 | H43 | H44 | 118.7° | 120.1° |