XP4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | P1 | sing | 1.55Å | 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 | C14 | sing | 1.53Å | 1.51Å | |
C13 | H23 | sing | 1.09Å | 1.11Å | |
C13 | H24 | sing | 1.09Å | 1.11Å | |
C14 | C15 | sing | 1.53Å | 1.51Å | |
C14 | H25 | sing | 1.09Å | 1.11Å | |
C14 | H26 | sing | 1.09Å | 1.11Å | |
C15 | C16 | sing | 1.53Å | 1.52Å | |
C15 | H27 | sing | 1.09Å | 1.11Å | |
C15 | H28 | sing | 1.09Å | 1.11Å | |
C16 | C17 | sing | 1.53Å | 1.52Å | |
C16 | H29 | sing | 1.09Å | 1.11Å | |
C16 | H30 | sing | 1.09Å | 1.11Å | |
C17 | H31 | sing | 1.09Å | 1.11Å | |
C17 | H32 | sing | 1.09Å | 1.11Å | |
C17 | H33 | sing | 1.09Å | 1.11Å | |
O7 | C18 | sing | 1.34Å | 1.48Å | |
C18 | O8 | doub | 1.21Å | 1.25Å | |
C18 | C19 | sing | 1.51Å | 1.52Å | |
C19 | C20 | sing | 1.53Å | 1.53Å | |
C19 | H34 | sing | 1.09Å | 1.11Å | |
C19 | H35 | sing | 1.09Å | 1.11Å | |
C20 | C21 | sing | 1.53Å | 1.53Å | |
C20 | H36 | sing | 1.09Å | 1.11Å | |
C20 | H37 | sing | 1.09Å | 1.11Å | |
C21 | C22 | sing | 1.53Å | 1.53Å | |
C21 | H38 | sing | 1.09Å | 1.11Å | |
C21 | H39 | sing | 1.09Å | 1.11Å | |
C22 | C23 | sing | 1.53Å | 1.53Å | |
C22 | H40 | sing | 1.09Å | 1.11Å | |
C22 | H41 | sing | 1.09Å | 1.11Å | |
C23 | C24 | sing | 1.53Å | 1.52Å | |
C23 | H42 | sing | 1.09Å | 1.11Å | |
C23 | H43 | sing | 1.09Å | 1.11Å | |
C24 | C25 | sing | 1.53Å | 1.51Å | |
C24 | H44 | sing | 1.09Å | 1.11Å | |
C24 | H45 | sing | 1.09Å | 1.11Å | |
C25 | C26 | sing | 1.53Å | 1.51Å | |
C25 | H46 | sing | 1.09Å | 1.11Å | |
C25 | H47 | sing | 1.09Å | 1.11Å | |
C26 | C27 | sing | 1.53Å | 1.52Å | |
C26 | H48 | sing | 1.09Å | 1.11Å | |
C26 | H49 | sing | 1.09Å | 1.11Å | |
C27 | C28 | sing | 1.53Å | 1.52Å | |
C27 | H50 | sing | 1.09Å | 1.11Å | |
C27 | H51 | sing | 1.09Å | 1.11Å | |
C28 | C29 | sing | 1.53Å | 1.52Å | |
C28 | H52 | sing | 1.09Å | 1.11Å | |
C28 | H53 | sing | 1.09Å | 1.11Å | |
C29 | C30 | sing | 1.53Å | 1.52Å | |
C29 | H54 | sing | 1.09Å | 1.11Å | |
C29 | H55 | sing | 1.09Å | 1.11Å | |
C30 | C31 | sing | 1.53Å | 1.52Å | |
C30 | H56 | sing | 1.09Å | 1.11Å | |
C30 | H57 | sing | 1.09Å | 1.11Å | |
C31 | H58 | sing | 1.09Å | 1.11Å | |
C31 | H59 | sing | 1.09Å | 1.11Å | |
C31 | H60 | 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 | 109.2° | 109.5° |
O1 | P1 | O4 | 110.0° | 109.5° |
O2 | P1 | O3 | 109.2° | 109.4° |
O2 | P1 | O4 | 109.7° | 109.5° |
O3 | P1 | O4 | 109.7° | 109.5° |
P1 | O3 | H1 | 110.0° | 106.8° |
P1 | O4 | C1 | 110.8° | 106.8° |
O4 | C1 | C2 | 109.6° | 109.5° |
O4 | C1 | H2 | 109.5° | 109.5° |
O4 | C1 | H3 | 109.5° | 109.5° |
C2 | C1 | H2 | 111.7° | 109.4° |
C2 | C1 | H3 | 111.6° | 109.4° |
C1 | C2 | C3 | 111.8° | 109.4° |
C1 | C2 | O7 | 109.8° | 109.5° |
C1 | C2 | H4 | 110.6° | 109.5° |
H2 | C1 | H3 | 104.8° | 109.4° |
C3 | C2 | O7 | 114.1° | 109.5° |
C3 | C2 | H4 | 105.8° | 109.4° |
C2 | C3 | O5 | 108.2° | 109.5° |
C2 | C3 | H5 | 112.2° | 109.5° |
C2 | C3 | H6 | 112.0° | 109.5° |
O7 | C2 | H4 | 104.5° | 109.5° |
C2 | O7 | C18 | 119.3° | 120.0° |
O5 | C3 | H5 | 109.6° | 109.5° |
O5 | C3 | H6 | 109.7° | 109.5° |
C3 | O5 | C4 | 113.0° | 120.0° |
H5 | C3 | H6 | 105.1° | 109.4° |
O5 | C4 | O6 | 121.7° | 120.0° |
O5 | C4 | C5 | 115.3° | 120.0° |
O6 | C4 | C5 | 123.0° | 120.0° |
C4 | C5 | C6 | 115.3° | 109.5° |
C4 | C5 | H7 | 109.1° | 109.5° |
C4 | C5 | H8 | 109.2° | 109.5° |
C6 | C5 | H7 | 108.9° | 109.5° |
C6 | C5 | H8 | 108.9° | 109.5° |
C5 | C6 | C7 | 112.1° | 109.5° |
C5 | C6 | H9 | 109.9° | 109.4° |
C5 | C6 | H10 | 110.1° | 109.5° |
H7 | C5 | H8 | 104.9° | 109.4° |
C7 | C6 | H9 | 109.7° | 109.5° |
C7 | C6 | H10 | 109.8° | 109.5° |
C6 | C7 | C8 | 111.8° | 109.5° |
C6 | C7 | H11 | 110.2° | 109.5° |
C6 | C7 | H12 | 110.2° | 109.5° |
H9 | C6 | H10 | 105.0° | 109.4° |
C8 | C7 | H11 | 109.7° | 109.5° |
C8 | C7 | H12 | 109.7° | 109.5° |
C7 | C8 | C9 | 111.1° | 109.4° |
C7 | C8 | H13 | 110.0° | 109.5° |
C7 | C8 | H14 | 110.0° | 109.5° |
H11 | C7 | H12 | 105.1° | 109.4° |
C9 | C8 | H13 | 110.2° | 109.4° |
C9 | C8 | H14 | 110.2° | 109.5° |
C8 | C9 | C10 | 111.0° | 109.5° |
C8 | C9 | H15 | 110.2° | 109.5° |
C8 | C9 | H16 | 110.1° | 109.5° |
H13 | C8 | H14 | 105.1° | 109.5° |
C10 | C9 | H15 | 110.3° | 109.4° |
C10 | C9 | H16 | 110.2° | 109.5° |
C9 | C10 | C11 | 111.7° | 109.5° |
C9 | C10 | H17 | 110.0° | 109.4° |
C9 | C10 | H18 | 110.0° | 109.5° |
H15 | C9 | H16 | 104.9° | 109.5° |
C11 | C10 | H17 | 110.0° | 109.5° |
C11 | C10 | H18 | 110.1° | 109.5° |
C10 | C11 | C12 | 111.7° | 109.4° |
C10 | C11 | H19 | 109.9° | 109.4° |
C10 | C11 | H20 | 110.1° | 109.5° |
H17 | C10 | H18 | 104.9° | 109.5° |
C12 | C11 | H19 | 109.9° | 109.5° |
C12 | C11 | H20 | 110.0° | 109.5° |
C11 | C12 | C13 | 111.3° | 109.4° |
C11 | C12 | H21 | 110.3° | 109.5° |
C11 | C12 | H22 | 110.2° | 109.5° |
H19 | C11 | H20 | 105.0° | 109.5° |
C13 | C12 | H21 | 110.0° | 109.4° |
C13 | C12 | H22 | 109.9° | 109.5° |
C12 | C13 | C14 | 111.0° | 109.5° |
C12 | C13 | H23 | 110.1° | 109.5° |
C12 | C13 | H24 | 110.1° | 109.5° |
H21 | C12 | H22 | 105.1° | 109.5° |
C14 | C13 | H23 | 110.3° | 109.5° |
C14 | C13 | H24 | 110.2° | 109.4° |
C13 | C14 | C15 | 110.8° | 109.5° |
C13 | C14 | H25 | 110.4° | 109.5° |
C13 | C14 | H26 | 110.2° | 109.5° |
H23 | C13 | H24 | 105.0° | 109.5° |
C15 | C14 | H25 | 110.2° | 109.5° |
C15 | C14 | H26 | 110.2° | 109.5° |
C14 | C15 | C16 | 111.5° | 109.4° |
C14 | C15 | H27 | 110.0° | 109.5° |
C14 | C15 | H28 | 109.9° | 109.4° |
H25 | C14 | H26 | 104.9° | 109.5° |
C16 | C15 | H27 | 110.1° | 109.5° |
C16 | C15 | H28 | 110.1° | 109.5° |
C15 | C16 | C17 | 110.9° | 109.5° |
C15 | C16 | H29 | 110.1° | 109.5° |
C15 | C16 | H30 | 110.1° | 109.5° |
H27 | C15 | H28 | 105.0° | 109.5° |
C17 | C16 | H29 | 110.3° | 109.5° |
C17 | C16 | H30 | 110.3° | 109.5° |
C16 | C17 | H31 | 110.0° | 109.5° |
C16 | C17 | H32 | 110.0° | 109.5° |
C16 | C17 | H33 | 110.0° | 109.5° |
H29 | C16 | H30 | 105.0° | 109.4° |
H31 | C17 | H32 | 109.0° | 109.5° |
H31 | C17 | H33 | 108.9° | 109.4° |
H32 | C17 | H33 | 108.9° | 109.4° |
O7 | C18 | O8 | 121.5° | 120.0° |
O7 | C18 | C19 | 117.7° | 120.0° |
O8 | C18 | C19 | 120.8° | 120.0° |
C18 | C19 | C20 | 112.9° | 109.5° |
C18 | C19 | H34 | 109.5° | 109.5° |
C18 | C19 | H35 | 109.4° | 109.5° |
C20 | C19 | H34 | 109.9° | 109.5° |
C20 | C19 | H35 | 109.9° | 109.5° |
C19 | C20 | C21 | 112.3° | 109.5° |
C19 | C20 | H36 | 109.9° | 109.5° |
C19 | C20 | H37 | 109.9° | 109.5° |
H34 | C19 | H35 | 105.0° | 109.5° |
C21 | C20 | H36 | 109.7° | 109.5° |
C21 | C20 | H37 | 109.7° | 109.5° |
C20 | C21 | C22 | 112.2° | 109.4° |
C20 | C21 | H38 | 109.9° | 109.4° |
C20 | C21 | H39 | 110.0° | 109.5° |
H36 | C20 | H37 | 105.0° | 109.4° |
C22 | C21 | H38 | 109.7° | 109.5° |
C22 | C21 | H39 | 109.9° | 109.5° |
C21 | C22 | C23 | 112.0° | 109.4° |
C21 | C22 | H40 | 109.8° | 109.5° |
C21 | C22 | H41 | 110.0° | 109.5° |
H38 | C21 | H39 | 104.9° | 109.5° |
C23 | C22 | H40 | 109.9° | 109.5° |
C23 | C22 | H41 | 110.0° | 109.5° |
C22 | C23 | C24 | 111.5° | 109.4° |
C22 | C23 | H42 | 110.1° | 109.5° |
C22 | C23 | H43 | 110.1° | 109.5° |
H40 | C22 | H41 | 105.1° | 109.5° |
C24 | C23 | H42 | 110.0° | 109.5° |
C24 | C23 | H43 | 110.0° | 109.4° |
C23 | C24 | C25 | 111.3° | 109.5° |
C23 | C24 | H44 | 110.3° | 109.5° |
C23 | C24 | H45 | 110.3° | 109.5° |
H42 | C23 | H43 | 105.0° | 109.5° |
C25 | C24 | H44 | 109.9° | 109.5° |
C25 | C24 | H45 | 109.9° | 109.5° |
C24 | C25 | C26 | 111.2° | 109.5° |
C24 | C25 | H46 | 110.2° | 109.5° |
C24 | C25 | H47 | 110.1° | 109.5° |
H44 | C24 | H45 | 105.0° | 109.5° |
C26 | C25 | H46 | 110.2° | 109.4° |
C26 | C25 | H47 | 110.1° | 109.4° |
C25 | C26 | C27 | 111.4° | 109.5° |
C25 | C26 | H48 | 110.0° | 109.5° |
C25 | C26 | H49 | 110.0° | 109.5° |
H46 | C25 | H47 | 105.0° | 109.5° |
C27 | C26 | H48 | 110.2° | 109.4° |
C27 | C26 | H49 | 110.2° | 109.5° |
C26 | C27 | C28 | 111.6° | 109.5° |
C26 | C27 | H50 | 110.0° | 109.5° |
C26 | C27 | H51 | 110.0° | 109.5° |
H48 | C26 | H49 | 105.0° | 109.5° |
C28 | C27 | H50 | 109.9° | 109.4° |
C28 | C27 | H51 | 110.0° | 109.4° |
C27 | C28 | C29 | 111.6° | 109.5° |
C27 | C28 | H52 | 110.0° | 109.5° |
C27 | C28 | H53 | 109.9° | 109.5° |
H50 | C27 | H51 | 105.1° | 109.5° |
C29 | C28 | H52 | 110.0° | 109.5° |
C29 | C28 | H53 | 110.0° | 109.4° |
C28 | C29 | C30 | 111.3° | 109.5° |
C28 | C29 | H54 | 110.1° | 109.4° |
C28 | C29 | H55 | 110.1° | 109.4° |
H52 | C28 | H53 | 105.1° | 109.5° |
C30 | C29 | H54 | 110.1° | 109.5° |
C30 | C29 | H55 | 110.2° | 109.4° |
C29 | C30 | C31 | 111.2° | 109.5° |
C29 | C30 | H56 | 110.0° | 109.5° |
C29 | C30 | H57 | 110.1° | 109.5° |
H54 | C29 | H55 | 105.0° | 109.5° |
C31 | C30 | H56 | 110.2° | 109.5° |
C31 | C30 | H57 | 110.2° | 109.5° |
C30 | C31 | H58 | 110.0° | 109.4° |
C30 | C31 | H59 | 110.1° | 109.4° |
C30 | C31 | H60 | 110.0° | 109.5° |
H56 | C30 | H57 | 105.0° | 109.4° |
H58 | C31 | H59 | 108.9° | 109.5° |
H58 | C31 | H60 | 108.9° | 109.5° |
H59 | C31 | H60 | 108.9° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | P1 | O2 | O3 | 119.3° | 120.0° |
O1 | P1 | O2 | O4 | 120.5° | 120.0° |
O1 | P1 | O3 | O4 | 120.6° | 120.0° |
O1 | P1 | O3 | H1 | 41.5° | 59.9° |
O1 | P1 | O4 | C1 | 85.5° | 55.0° |
O2 | P1 | O3 | O4 | 120.2° | 120.0° |
O2 | P1 | O3 | H1 | 160.7° | 60.0° |
O2 | P1 | O4 | C1 | 154.6° | 65.0° |
O3 | P1 | O4 | C1 | 34.7° | 175.0° |
O4 | P1 | O3 | H1 | 79.1° | 180.0° |
P1 | O4 | C1 | C2 | 84.3° | 180.0° |
P1 | O4 | C1 | H2 | 152.8° | 60.0° |
P1 | O4 | C1 | H3 | 38.4° | 60.0° |
O4 | C1 | C2 | H2 | 121.6° | 120.1° |
O4 | C1 | C2 | H3 | 121.4° | 120.1° |
O4 | C1 | H2 | H3 | 117.4° | 120.1° |
O4 | C1 | C2 | C3 | 11.8° | 55.0° |
O4 | C1 | C2 | O7 | 139.5° | 65.0° |
O4 | C1 | C2 | H4 | 105.8° | 175.0° |
C2 | C1 | H2 | H3 | 121.0° | 119.9° |
C1 | C2 | C3 | O7 | 125.3° | 120.0° |
C1 | C2 | C3 | H4 | 120.4° | 120.0° |
C1 | C2 | O7 | H4 | 118.6° | 120.1° |
C1 | C2 | C3 | O5 | 153.1° | 55.0° |
C1 | C2 | C3 | H5 | 32.0° | 65.1° |
C1 | C2 | C3 | H6 | 85.9° | 175.0° |
C1 | C2 | O7 | C18 | 65.7° | 90.1° |
H2 | C1 | C2 | C3 | 109.8° | 65.1° |
H2 | C1 | C2 | O7 | 17.9° | 175.0° |
H2 | C1 | C2 | H4 | 132.7° | 54.9° |
H3 | C1 | C2 | C3 | 133.2° | 175.1° |
H3 | C1 | C2 | O7 | 99.1° | 55.1° |
H3 | C1 | C2 | H4 | 15.6° | 65.0° |
C3 | C2 | O7 | H4 | 115.0° | 120.0° |
C2 | C3 | O5 | H5 | 122.6° | 120.0° |
C2 | C3 | O5 | H6 | 122.5° | 120.0° |
C2 | C3 | H5 | H6 | 122.0° | 120.0° |
C2 | C3 | O5 | C4 | 94.0° | 180.0° |
C3 | C2 | O7 | C18 | 167.9° | 150.0° |
O7 | C2 | C3 | O5 | 27.8° | 65.0° |
O7 | C2 | C3 | H5 | 93.3° | 175.0° |
O7 | C2 | C3 | H6 | 148.8° | 55.0° |
C2 | O7 | C18 | O8 | 179.3° | 0.0° |
C2 | O7 | C18 | C19 | 2.3° | 180.0° |
H4 | C2 | C3 | O5 | 86.5° | 175.0° |
H4 | C2 | C3 | H5 | 152.4° | 55.0° |
H4 | C2 | C3 | H6 | 34.5° | 65.0° |
H4 | C2 | O7 | C18 | 52.9° | 30.0° |
O5 | C3 | H5 | H6 | 117.8° | 120.0° |
C3 | O5 | C4 | O6 | 28.5° | 0.0° |
C3 | O5 | C4 | C5 | 151.9° | 180.0° |
H5 | C3 | O5 | C4 | 143.4° | 60.0° |
H6 | C3 | O5 | C4 | 28.5° | 60.0° |
O5 | C4 | O6 | C5 | 179.6° | 179.9° |
O5 | C4 | C5 | C6 | 9.8° | 180.0° |
O5 | C4 | C5 | H7 | 132.8° | 60.0° |
O5 | C4 | C5 | H8 | 113.1° | 59.9° |
O6 | C4 | C5 | C6 | 169.8° | 0.0° |
O6 | C4 | C5 | H7 | 46.8° | 120.1° |
O6 | C4 | C5 | H8 | 67.3° | 120.0° |
C4 | C5 | C6 | H7 | 123.1° | 120.0° |
C4 | C5 | C6 | H8 | 123.1° | 120.0° |
C4 | C5 | H7 | H8 | 116.9° | 119.9° |
C4 | C5 | C6 | C7 | 85.4° | 180.0° |
C4 | C5 | C6 | H9 | 36.9° | 60.0° |
C4 | C5 | C6 | H10 | 152.1° | 60.0° |
C6 | C5 | H7 | H8 | 116.4° | 120.0° |
C5 | C6 | C7 | H9 | 122.3° | 120.0° |
C5 | C6 | C7 | H10 | 122.7° | 120.0° |
C5 | C6 | H9 | H10 | 118.4° | 120.0° |
C5 | C6 | C7 | C8 | 62.1° | 180.0° |
C5 | C6 | C7 | H11 | 175.7° | 60.0° |
C5 | C6 | C7 | H12 | 60.2° | 60.0° |
H7 | C5 | C6 | C7 | 37.7° | 60.0° |
H7 | C5 | C6 | H9 | 160.0° | 60.0° |
H7 | C5 | C6 | H10 | 84.9° | 180.0° |
H8 | C5 | C6 | C7 | 151.6° | 60.0° |
H8 | C5 | C6 | H9 | 86.1° | 180.0° |
H8 | C5 | C6 | H10 | 29.0° | 60.1° |
C7 | C6 | H9 | H10 | 118.0° | 120.0° |
C6 | C7 | C8 | H11 | 122.6° | 120.0° |
C6 | C7 | C8 | H12 | 122.5° | 120.0° |
C6 | C7 | H11 | H12 | 118.7° | 120.0° |
C6 | C7 | C8 | C9 | 152.2° | 180.0° |
C6 | C7 | C8 | H13 | 29.9° | 60.0° |
C6 | C7 | C8 | H14 | 85.4° | 60.0° |
H9 | C6 | C7 | C8 | 175.6° | 60.0° |
H9 | C6 | C7 | H11 | 53.3° | 60.0° |
H9 | C6 | C7 | H12 | 62.2° | 180.0° |
H10 | C6 | C7 | C8 | 60.7° | 60.0° |
H10 | C6 | C7 | H11 | 61.6° | 180.0° |
H10 | C6 | C7 | H12 | 177.1° | 60.0° |
C8 | C7 | H11 | H12 | 117.8° | 120.0° |
C7 | C8 | C9 | H13 | 122.2° | 120.0° |
C7 | C8 | C9 | H14 | 122.2° | 120.0° |
C7 | C8 | H13 | H14 | 118.4° | 120.1° |
C7 | C8 | C9 | C10 | 166.1° | 180.0° |
C7 | C8 | C9 | H15 | 71.4° | 60.1° |
C7 | C8 | C9 | H16 | 43.8° | 60.0° |
H11 | C7 | C8 | C9 | 29.6° | 60.0° |
H11 | C7 | C8 | H13 | 92.7° | 179.9° |
H11 | C7 | C8 | H14 | 152.0° | 60.0° |
H12 | C7 | C8 | C9 | 85.2° | 60.0° |
H12 | C7 | C8 | H13 | 152.4° | 60.0° |
H12 | C7 | C8 | H14 | 37.1° | 180.0° |
C9 | C8 | H13 | H14 | 118.7° | 120.0° |
C8 | C9 | C10 | H15 | 122.4° | 120.0° |
C8 | C9 | C10 | H16 | 122.2° | 120.1° |
C8 | C9 | H15 | H16 | 118.4° | 120.1° |
C8 | C9 | C10 | C11 | 36.8° | NaN° |
C8 | C9 | C10 | H17 | 85.7° | 60.0° |
C8 | C9 | C10 | H18 | 159.3° | 60.0° |
H13 | C8 | C9 | C10 | 71.7° | 60.0° |
H13 | C8 | C9 | H15 | 50.8° | 179.9° |
H13 | C8 | C9 | H16 | 166.0° | 60.0° |
H14 | C8 | C9 | C10 | 43.9° | 60.0° |
H14 | C8 | C9 | H15 | 166.3° | 59.9° |
H14 | C8 | C9 | H16 | 78.5° | 180.0° |
C10 | C9 | H15 | H16 | 118.7° | 119.9° |
C9 | C10 | C11 | H17 | 122.5° | 119.9° |
C9 | C10 | C11 | H18 | 122.5° | 120.0° |
C9 | C10 | H17 | H18 | 118.2° | 120.0° |
C9 | C10 | C11 | C12 | 176.5° | 180.0° |
C9 | C10 | C11 | H19 | 54.2° | 60.0° |
C9 | C10 | C11 | H20 | 60.9° | 60.0° |
H15 | C9 | C10 | C11 | 85.6° | 60.0° |
H15 | C9 | C10 | H17 | 152.0° | 180.0° |
H15 | C9 | C10 | H18 | 37.0° | 60.0° |
H16 | C9 | C10 | C11 | 159.1° | 59.9° |
H16 | C9 | C10 | H17 | 36.6° | 60.1° |
H16 | C9 | C10 | H18 | 78.4° | 180.0° |
C11 | C10 | H17 | H18 | 118.3° | 120.1° |
C10 | C11 | C12 | H19 | 122.3° | 119.9° |
C10 | C11 | C12 | H20 | 122.6° | 120.0° |
C10 | C11 | H19 | H20 | 118.4° | 120.0° |
C10 | C11 | C12 | C13 | 79.4° | 180.0° |
C10 | C11 | C12 | H21 | 42.9° | 60.1° |
C10 | C11 | C12 | H22 | 158.5° | 60.0° |
H17 | C10 | C11 | C12 | 54.1° | 60.0° |
H17 | C10 | C11 | H19 | 68.2° | 180.0° |
H17 | C10 | C11 | H20 | 176.6° | 60.0° |
H18 | C10 | C11 | C12 | 61.0° | 60.0° |
H18 | C10 | C11 | H19 | 176.7° | 60.0° |
H18 | C10 | C11 | H20 | 61.5° | 180.0° |
C12 | C11 | H19 | H20 | 118.3° | 120.0° |
C11 | C12 | C13 | H21 | 122.5° | 120.0° |
C11 | C12 | C13 | H22 | 122.3° | 120.0° |
C11 | C12 | H21 | H22 | 118.7° | 120.0° |
C11 | C12 | C13 | C14 | 103.5° | 180.0° |
C11 | C12 | C13 | H23 | 18.9° | 60.0° |
C11 | C12 | C13 | H24 | 134.2° | 60.0° |
H19 | C11 | C12 | C13 | 42.9° | 60.1° |
H19 | C11 | C12 | H21 | 165.2° | 180.0° |
H19 | C11 | C12 | H22 | 79.3° | 60.0° |
H20 | C11 | C12 | C13 | 158.1° | 60.0° |
H20 | C11 | C12 | H21 | 79.6° | 60.0° |
H20 | C11 | C12 | H22 | 35.9° | 180.0° |
C13 | C12 | H21 | H22 | 118.2° | 120.0° |
C12 | C13 | C14 | H23 | 122.3° | 120.0° |
C12 | C13 | C14 | H24 | 122.2° | 120.0° |
C12 | C13 | H23 | H24 | 118.4° | 120.0° |
C12 | C13 | C14 | C15 | 67.7° | 180.0° |
C12 | C13 | C14 | H25 | 170.0° | 60.0° |
C12 | C13 | C14 | H26 | 54.6° | 60.0° |
H21 | C12 | C13 | C14 | 19.0° | 60.0° |
H21 | C12 | C13 | H23 | 141.4° | 180.0° |
H21 | C12 | C13 | H24 | 103.3° | 60.0° |
H22 | C12 | C13 | C14 | 134.2° | 60.0° |
H22 | C12 | C13 | H23 | 103.4° | 60.0° |
H22 | C12 | C13 | H24 | 11.9° | 180.0° |
C14 | C13 | H23 | H24 | 118.7° | 120.0° |
C13 | C14 | C15 | H25 | 122.5° | 120.0° |
C13 | C14 | C15 | H26 | 122.3° | 120.0° |
C13 | C14 | H25 | H26 | 118.7° | 120.0° |
C13 | C14 | C15 | C16 | 159.8° | 180.0° |
C13 | C14 | C15 | H27 | 77.7° | 60.0° |
C13 | C14 | C15 | H28 | 37.4° | 60.0° |
H23 | C13 | C14 | C15 | 170.0° | 60.0° |
H23 | C13 | C14 | H25 | 47.7° | NaN° |
H23 | C13 | C14 | H26 | 67.7° | 60.0° |
H24 | C13 | C14 | C15 | 54.6° | 60.0° |
H24 | C13 | C14 | H25 | 67.7° | 60.0° |
H24 | C13 | C14 | H26 | 176.8° | 180.0° |
C15 | C14 | H25 | H26 | 118.6° | 120.0° |
C14 | C15 | C16 | H27 | 122.4° | 120.0° |
C14 | C15 | C16 | H28 | 122.3° | 119.9° |
C14 | C15 | H27 | H28 | 118.2° | 120.0° |
C14 | C15 | C16 | C17 | 63.3° | 180.0° |
C14 | C15 | C16 | H29 | 174.4° | 59.9° |
C14 | C15 | C16 | H30 | 59.0° | 60.0° |
H25 | C14 | C15 | C16 | 77.7° | 60.0° |
H25 | C14 | C15 | H27 | 44.7° | 180.0° |
H25 | C14 | C15 | H28 | 159.8° | 60.0° |
H26 | C14 | C15 | C16 | 37.5° | 60.0° |
H26 | C14 | C15 | H27 | 160.0° | 60.0° |
H26 | C14 | C15 | H28 | 84.9° | 180.0° |
C16 | C15 | H27 | H28 | 118.5° | 120.1° |
C15 | C16 | C17 | H29 | 122.2° | 120.0° |
C15 | C16 | C17 | H30 | 122.2° | 120.0° |
C15 | C16 | H29 | H30 | 118.5° | 120.0° |
C15 | C16 | C17 | H31 | 107.2° | 60.0° |
C15 | C16 | C17 | H32 | 132.7° | 180.0° |
C15 | C16 | C17 | H33 | 12.7° | 60.0° |
H27 | C15 | C16 | C17 | 174.4° | 60.0° |
H27 | C15 | C16 | H29 | 52.0° | 179.9° |
H27 | C15 | C16 | H30 | 63.3° | 60.0° |
H28 | C15 | C16 | C17 | 59.0° | 60.0° |
H28 | C15 | C16 | H29 | 63.3° | 60.0° |
H28 | C15 | C16 | H30 | 178.6° | 180.0° |
C17 | C16 | H29 | H30 | 118.8° | 120.0° |
C16 | C17 | H31 | H32 | 120.7° | 120.1° |
C16 | C17 | H31 | H33 | 120.6° | 120.0° |
C16 | C17 | H32 | H33 | 120.6° | 120.0° |
H29 | C16 | C17 | H31 | 15.0° | 180.0° |
H29 | C16 | C17 | H32 | 105.1° | 60.0° |
H29 | C16 | C17 | H33 | 135.0° | 60.0° |
H30 | C16 | C17 | H31 | 130.5° | 60.0° |
H30 | C16 | C17 | H32 | 10.4° | 60.0° |
H30 | C16 | C17 | H33 | 109.5° | 180.0° |
H31 | C17 | H32 | H33 | 118.7° | 119.9° |
O7 | C18 | O8 | C19 | 178.3° | 179.9° |
O7 | C18 | C19 | C20 | 67.6° | 180.0° |
O7 | C18 | C19 | H34 | 169.6° | 60.0° |
O7 | C18 | C19 | H35 | 55.1° | 60.0° |
O8 | C18 | C19 | C20 | 114.0° | 0.0° |
O8 | C18 | C19 | H34 | 8.8° | 120.0° |
O8 | C18 | C19 | H35 | 123.3° | 120.0° |
C18 | C19 | C20 | H34 | 122.5° | 120.0° |
C18 | C19 | C20 | H35 | 122.5° | 120.0° |
C18 | C19 | H34 | H35 | 117.4° | 120.0° |
C18 | C19 | C20 | C21 | 25.4° | 180.0° |
C18 | C19 | C20 | H36 | 97.0° | 60.0° |
C18 | C19 | C20 | H37 | 147.9° | 59.9° |
C20 | C19 | H34 | H35 | 118.1° | 120.0° |
C19 | C20 | C21 | H36 | 122.6° | 120.0° |
C19 | C20 | C21 | H37 | 122.6° | 120.1° |
C19 | C20 | H36 | H37 | 118.2° | 120.0° |
C19 | C20 | C21 | C22 | 150.6° | 180.0° |
C19 | C20 | C21 | H38 | 87.0° | 60.0° |
C19 | C20 | C21 | H39 | 28.0° | 60.0° |
H34 | C19 | C20 | C21 | 97.1° | 60.0° |
H34 | C19 | C20 | H36 | 140.5° | 180.0° |
H34 | C19 | C20 | H37 | 25.4° | 60.1° |
H35 | C19 | C20 | C21 | 147.9° | 60.0° |
H35 | C19 | C20 | H36 | 25.5° | 60.0° |
H35 | C19 | C20 | H37 | 89.6° | 179.9° |
C21 | C20 | H36 | H37 | 117.9° | 120.0° |
C20 | C21 | C22 | H38 | 122.5° | 119.9° |
C20 | C21 | C22 | H39 | 122.7° | 120.0° |
C20 | C21 | H38 | H39 | 118.2° | 120.1° |
C20 | C21 | C22 | C23 | 80.9° | 180.0° |
C20 | C21 | C22 | H40 | 41.5° | 60.1° |
C20 | C21 | C22 | H41 | 156.6° | 60.0° |
H36 | C20 | C21 | C22 | 86.8° | 60.0° |
H36 | C20 | C21 | H38 | 35.6° | 180.0° |
H36 | C20 | C21 | H39 | 150.6° | 60.0° |
H37 | C20 | C21 | C22 | 28.1° | 59.9° |
H37 | C20 | C21 | H38 | 150.4° | 60.0° |
H37 | C20 | C21 | H39 | 94.5° | 179.9° |
C22 | C21 | H38 | H39 | 118.0° | 120.0° |
C21 | C22 | C23 | H40 | 122.2° | 120.0° |
C21 | C22 | C23 | H41 | 122.6° | 120.0° |
C21 | C22 | H40 | H41 | 118.2° | 120.0° |
C21 | C22 | C23 | C24 | 104.5° | 180.0° |
C21 | C22 | C23 | H42 | 133.1° | 60.1° |
C21 | C22 | C23 | H43 | 17.9° | 60.1° |
H38 | C21 | C22 | C23 | 41.6° | 60.0° |
H38 | C21 | C22 | H40 | 163.9° | 180.0° |
H38 | C21 | C22 | H41 | 81.0° | 59.9° |
H39 | C21 | C22 | C23 | 156.5° | 60.0° |
H39 | C21 | C22 | H40 | 81.2° | 60.0° |
H39 | C21 | C22 | H41 | 33.9° | 180.0° |
C23 | C22 | H40 | H41 | 118.3° | 120.0° |
C22 | C23 | C24 | H42 | 122.4° | 120.0° |
C22 | C23 | C24 | H43 | 122.5° | 120.0° |
C22 | C23 | H42 | H43 | 118.5° | 120.1° |
C22 | C23 | C24 | C25 | 93.2° | 180.0° |
C22 | C23 | C24 | H44 | 29.1° | 60.0° |
C22 | C23 | C24 | H45 | 144.6° | 60.1° |
H40 | C22 | C23 | C24 | 133.2° | 60.0° |
H40 | C22 | C23 | H42 | 10.9° | 180.0° |
H40 | C22 | C23 | H43 | 104.4° | 59.9° |
H41 | C22 | C23 | C24 | 18.1° | 60.0° |
H41 | C22 | C23 | H42 | 104.3° | 59.9° |
H41 | C22 | C23 | H43 | 140.4° | 180.0° |
C24 | C23 | H42 | H43 | 118.2° | 120.0° |
C23 | C24 | C25 | H44 | 122.5° | 120.1° |
C23 | C24 | C25 | H45 | 122.5° | 120.0° |
C23 | C24 | H44 | H45 | 118.8° | 120.0° |
C23 | C24 | C25 | C26 | 100.5° | 180.0° |
C23 | C24 | C25 | H46 | 137.1° | 60.0° |
C23 | C24 | C25 | H47 | 21.8° | 60.1° |
H42 | C23 | C24 | C25 | 29.3° | 60.0° |
H42 | C23 | C24 | H44 | 151.5° | 180.0° |
H42 | C23 | C24 | H45 | 93.0° | 60.0° |
H43 | C23 | C24 | C25 | 144.4° | 60.0° |
H43 | C23 | C24 | H44 | 93.4° | 60.0° |
H43 | C23 | C24 | H45 | 22.1° | 180.0° |
C25 | C24 | H44 | H45 | 118.1° | 120.0° |
C24 | C25 | C26 | H46 | 122.4° | 120.0° |
C24 | C25 | C26 | H47 | 122.3° | 120.1° |
C24 | C25 | H46 | H47 | 118.5° | 120.1° |
C24 | C25 | C26 | C27 | 68.9° | 180.0° |
C24 | C25 | C26 | H48 | 168.6° | 60.0° |
C24 | C25 | C26 | H49 | 53.6° | 60.0° |
H44 | C24 | C25 | C26 | 137.1° | 60.0° |
H44 | C24 | C25 | H46 | 14.6° | 179.9° |
H44 | C24 | C25 | H47 | 100.7° | 60.0° |
H45 | C24 | C25 | C26 | 22.0° | 60.0° |
H45 | C24 | C25 | H46 | 100.4° | 60.0° |
H45 | C24 | C25 | H47 | 144.3° | 180.0° |
C26 | C25 | H46 | H47 | 118.5° | 119.9° |
C25 | C26 | C27 | H48 | 122.3° | 120.0° |
C25 | C26 | C27 | H49 | 122.3° | 120.0° |
C25 | C26 | H48 | H49 | 118.2° | 120.0° |
C25 | C26 | C27 | C28 | 153.5° | NaN° |
C25 | C26 | C27 | H50 | 31.2° | 60.1° |
C25 | C26 | C27 | H51 | 84.1° | 60.0° |
H46 | C25 | C26 | C27 | 168.7° | 60.0° |
H46 | C25 | C26 | H48 | 46.2° | 180.0° |
H46 | C25 | C26 | H49 | 68.9° | 60.0° |
H47 | C25 | C26 | C27 | 53.4° | 59.9° |
H47 | C25 | C26 | H48 | 69.1° | 60.0° |
H47 | C25 | C26 | H49 | 175.8° | 180.0° |
C27 | C26 | H48 | H49 | 118.6° | 120.0° |
C26 | C27 | C28 | H50 | 122.4° | 120.0° |
C26 | C27 | C28 | H51 | 122.4° | 120.1° |
C26 | C27 | H50 | H51 | 118.3° | 120.1° |
C26 | C27 | C28 | C29 | 89.5° | 180.0° |
C26 | C27 | C28 | H52 | 32.9° | 60.0° |
C26 | C27 | C28 | H53 | 148.2° | 60.0° |
H48 | C26 | C27 | C28 | 31.2° | 60.0° |
H48 | C26 | C27 | H50 | 91.1° | 180.0° |
H48 | C26 | C27 | H51 | 153.6° | 60.0° |
H49 | C26 | C27 | C28 | 84.2° | 60.0° |
H49 | C26 | C27 | H50 | 153.5° | 60.0° |
H49 | C26 | C27 | H51 | 38.2° | 180.0° |
C28 | C27 | H50 | H51 | 118.4° | 119.9° |
C27 | C28 | C29 | H52 | 122.4° | 120.0° |
C27 | C28 | C29 | H53 | 122.2° | 120.0° |
C27 | C28 | H52 | H53 | 118.3° | 120.0° |
C27 | C28 | C29 | C30 | 97.6° | 180.0° |
C27 | C28 | C29 | H54 | 24.8° | 60.0° |
C27 | C28 | C29 | H55 | 140.0° | 60.0° |
H50 | C27 | C28 | C29 | 32.8° | 60.0° |
H50 | C27 | C28 | H52 | 155.3° | 180.0° |
H50 | C27 | C28 | H53 | 89.5° | 60.0° |
H51 | C27 | C28 | C29 | 148.1° | 60.0° |
H51 | C27 | C28 | H52 | 89.5° | 60.0° |
H51 | C27 | C28 | H53 | 25.8° | 180.0° |
C29 | C28 | H52 | H53 | 118.4° | 120.0° |
C28 | C29 | C30 | H54 | 122.3° | 120.0° |
C28 | C29 | C30 | H55 | 122.4° | 120.0° |
C28 | C29 | H54 | H55 | 118.4° | 120.0° |
C28 | C29 | C30 | C31 | 104.1° | NaN° |
C28 | C29 | C30 | H56 | 133.5° | 59.9° |
C28 | C29 | C30 | H57 | 18.3° | 60.0° |
H52 | C28 | C29 | C30 | 24.9° | 60.0° |
H52 | C28 | C29 | H54 | 147.2° | 180.0° |
H52 | C28 | C29 | H55 | 97.5° | 60.0° |
H53 | C28 | C29 | C30 | 140.2° | 60.0° |
H53 | C28 | C29 | H54 | 97.5° | 60.0° |
H53 | C28 | C29 | H55 | 17.8° | NaN° |
C30 | C29 | H54 | H55 | 118.5° | 120.0° |
C29 | C30 | C31 | H56 | 122.2° | 120.1° |
C29 | C30 | C31 | H57 | 122.4° | 120.0° |
C29 | C30 | H56 | H57 | 118.4° | 119.9° |
C29 | C30 | C31 | H58 | 116.8° | 60.0° |
C29 | C30 | C31 | H59 | 123.2° | 60.0° |
C29 | C30 | C31 | H60 | 3.1° | 180.0° |
H54 | C29 | C30 | C31 | 133.6° | 60.0° |
H54 | C29 | C30 | H56 | 11.2° | 179.9° |
H54 | C29 | C30 | H57 | 104.0° | 60.0° |
H55 | C29 | C30 | C31 | 18.3° | 60.0° |
H55 | C29 | C30 | H56 | 104.1° | 60.0° |
H55 | C29 | C30 | H57 | 140.7° | 179.9° |
C31 | C30 | H56 | H57 | 118.6° | 120.0° |
C30 | C31 | H58 | H59 | 120.7° | 120.0° |
C30 | C31 | H58 | H60 | 120.6° | 120.0° |
C30 | C31 | H59 | H60 | 120.7° | 120.0° |
H56 | C30 | C31 | H58 | 5.4° | 180.0° |
H56 | C30 | C31 | H59 | 114.6° | 60.1° |
H56 | C30 | C31 | H60 | 125.4° | 59.9° |
H57 | C30 | C31 | H58 | 120.9° | 60.0° |
H57 | C30 | C31 | H59 | 0.8° | 180.0° |
H57 | C30 | C31 | H60 | 119.2° | 60.0° |
H58 | C31 | H59 | H60 | 118.6° | 120.1° |