OXV
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C42 | C41 | doub | 0.00Å | 1.42Å | Aromatic |
C42 | C43 | sing | 0.00Å | 1.41Å | Aromatic |
C41 | C40 | sing | 0.00Å | 1.41Å | Aromatic |
C43 | C38 | doub | 0.00Å | 1.41Å | Aromatic |
C40 | C39 | doub | 0.00Å | 1.41Å | Aromatic |
C38 | C39 | sing | 0.00Å | 1.43Å | Aromatic |
C38 | N36 | sing | 0.00Å | 1.52Å | Aromatic |
C39 | C33 | sing | 0.00Å | 1.53Å | Aromatic |
C37 | N36 | sing | 0.00Å | 1.45Å | |
N36 | C35 | doub | 0.00Å | 1.46Å | Aromatic |
C33 | C32 | sing | 0.00Å | 1.35Å | |
C33 | C34 | doub | 0.00Å | 1.47Å | Aromatic |
C32 | C24 | sing | 0.00Å | 1.55Å | |
C35 | C34 | sing | 0.00Å | 1.49Å | Aromatic |
C24 | N23 | doub | 0.00Å | 1.40Å | Aromatic |
C24 | S25 | sing | 0.00Å | 1.67Å | Aromatic |
C22 | N23 | sing | 0.00Å | 1.45Å | |
C22 | C20 | sing | 0.00Å | 1.54Å | |
N23 | C27 | sing | 0.00Å | 1.46Å | Aromatic |
S25 | C26 | sing | 0.00Å | 1.64Å | Aromatic |
C27 | C26 | doub | 0.00Å | 1.38Å | Aromatic |
C27 | C28 | sing | 0.00Å | 1.42Å | Aromatic |
C20 | O21 | doub | 0.00Å | 1.19Å | |
C20 | N19 | sing | 0.00Å | 1.46Å | |
C26 | C31 | sing | 0.00Å | 1.39Å | Aromatic |
C28 | C29 | doub | 0.00Å | 1.38Å | Aromatic |
C31 | C30 | doub | 0.00Å | 1.39Å | Aromatic |
N19 | C18 | sing | 0.00Å | 1.45Å | |
C29 | C30 | sing | 0.00Å | 1.40Å | Aromatic |
C18 | C17 | sing | 0.00Å | 1.54Å | |
O16 | C17 | sing | 0.00Å | 1.41Å | |
O16 | C15 | sing | 0.00Å | 1.41Å | |
C12 | O13 | sing | 0.00Å | 1.41Å | |
C12 | C11 | sing | 0.00Å | 1.54Å | |
C14 | O13 | sing | 0.00Å | 1.41Å | |
C14 | C15 | sing | 0.00Å | 1.54Å | |
O10 | C11 | sing | 0.00Å | 1.40Å | |
O10 | C09 | sing | 0.00Å | 1.40Å | |
C09 | C08 | sing | 0.00Å | 1.54Å | |
C08 | N07 | sing | 0.00Å | 1.46Å | |
N07 | C05 | sing | 0.00Å | 1.46Å | |
O06 | C05 | doub | 0.00Å | 1.18Å | |
C05 | C04 | sing | 0.00Å | 1.53Å | |
C04 | C03 | sing | 0.00Å | 1.53Å | |
C02 | C03 | sing | 0.00Å | 1.53Å | |
C02 | C01 | sing | 0.00Å | 1.52Å | |
C11 | H1 | sing | 0.00Å | 1.10Å | |
C11 | H2 | sing | 0.00Å | 1.10Å | |
C12 | H3 | sing | 0.00Å | 1.10Å | |
C12 | H4 | sing | 0.00Å | 1.10Å | |
C01 | H5 | sing | 0.00Å | 1.10Å | |
C01 | H6 | sing | 0.00Å | 1.10Å | |
C01 | H7 | sing | 0.00Å | 1.10Å | |
C02 | H8 | sing | 0.00Å | 1.10Å | |
C02 | H9 | sing | 0.00Å | 1.10Å | |
C03 | H10 | sing | 0.00Å | 1.10Å | |
C03 | H11 | sing | 0.00Å | 1.10Å | |
C04 | H12 | sing | 0.00Å | 1.10Å | |
C04 | H13 | sing | 0.00Å | 1.10Å | |
C08 | H14 | sing | 0.00Å | 1.10Å | |
C08 | H15 | sing | 0.00Å | 1.10Å | |
C09 | H16 | sing | 0.00Å | 1.10Å | |
C09 | H17 | sing | 0.00Å | 1.10Å | |
C14 | H18 | sing | 0.00Å | 1.10Å | |
C14 | H19 | sing | 0.00Å | 1.10Å | |
C15 | H20 | sing | 0.00Å | 1.10Å | |
C15 | H21 | sing | 0.00Å | 1.10Å | |
C17 | H22 | sing | 0.00Å | 1.10Å | |
C17 | H23 | sing | 0.00Å | 1.10Å | |
C18 | H24 | sing | 0.00Å | 1.10Å | |
C18 | H25 | sing | 0.00Å | 1.10Å | |
C22 | H26 | sing | 0.00Å | 1.10Å | |
C22 | H27 | sing | 0.00Å | 1.10Å | |
C28 | H28 | sing | 0.00Å | 1.08Å | |
C29 | H29 | sing | 0.00Å | 1.08Å | |
C30 | H30 | sing | 0.00Å | 1.08Å | |
C31 | H31 | sing | 0.00Å | 1.08Å | |
C32 | H32 | sing | 0.00Å | 1.10Å | |
C32 | H33 | sing | 0.00Å | 1.10Å | |
C34 | H34 | sing | 0.00Å | 1.08Å | |
C35 | H35 | sing | 0.00Å | 1.08Å | |
C37 | H36 | sing | 0.00Å | 1.10Å | |
C37 | H37 | sing | 0.00Å | 1.10Å | |
C37 | H38 | sing | 0.00Å | 1.10Å | |
C40 | H39 | sing | 0.00Å | 1.08Å | |
C41 | H40 | sing | 0.00Å | 1.08Å | |
C42 | H41 | sing | 0.00Å | 1.08Å | |
C43 | H42 | sing | 0.00Å | 1.08Å | |
N07 | H43 | sing | 0.00Å | 1.00Å | |
N19 | H44 | sing | 0.00Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C41 | C42 | C43 | 118.7° | 90.0° |
C42 | C41 | C40 | 121.8° | 90.0° |
C42 | C41 | H40 | 119.1° | 90.0° |
C41 | C42 | H41 | 120.6° | 90.0° |
C42 | C43 | C38 | 119.7° | 90.0° |
C43 | C42 | H41 | 120.7° | 90.0° |
C42 | C43 | H42 | 120.2° | 90.0° |
C41 | C40 | C39 | 119.5° | 90.0° |
C41 | C40 | H39 | 120.3° | 90.0° |
C40 | C41 | H40 | 119.1° | 90.0° |
C43 | C38 | C39 | 121.4° | 90.0° |
C43 | C38 | N36 | 118.4° | 90.0° |
C38 | C43 | H42 | 120.1° | 90.0° |
C40 | C39 | C38 | 118.9° | 90.0° |
C40 | C39 | C33 | 119.6° | 90.0° |
C39 | C40 | H39 | 120.3° | 90.0° |
C39 | C38 | N36 | 120.2° | 90.0° |
C38 | C39 | C33 | 121.5° | 90.0° |
C38 | N36 | C37 | 120.1° | 90.0° |
C38 | N36 | C35 | 119.5° | 90.0° |
C39 | C33 | C32 | 120.1° | 90.0° |
C39 | C33 | C34 | 117.0° | 90.0° |
C37 | N36 | C35 | 120.3° | 90.0° |
N36 | C37 | H36 | 109.5° | 90.0° |
N36 | C37 | H37 | 109.5° | 90.0° |
N36 | C37 | H38 | 109.5° | 90.0° |
N36 | C35 | C34 | 120.0° | 90.0° |
N36 | C35 | H35 | 120.0° | 90.0° |
C32 | C33 | C34 | 122.8° | 90.0° |
C33 | C32 | C24 | 128.5° | 90.0° |
C33 | C32 | H32 | 104.5° | 90.0° |
C33 | C32 | H33 | 104.5° | 90.0° |
C33 | C34 | C35 | 121.8° | 90.0° |
C33 | C34 | H34 | 119.1° | 90.0° |
C32 | C24 | N23 | 125.9° | 90.0° |
C32 | C24 | S25 | 126.0° | 90.0° |
C24 | C32 | H32 | 104.5° | 90.0° |
C24 | C32 | H33 | 104.5° | 90.0° |
C35 | C34 | H34 | 119.1° | 90.0° |
C34 | C35 | H35 | 120.0° | 90.0° |
N23 | C24 | S25 | 108.1° | 90.0° |
C24 | N23 | C22 | 129.1° | 90.0° |
C24 | N23 | C27 | 109.6° | 90.0° |
C24 | S25 | C26 | 100.0° | 90.0° |
N23 | C22 | C20 | 107.6° | 90.0° |
C22 | N23 | C27 | 121.3° | 90.0° |
N23 | C22 | H26 | 109.9° | 90.0° |
N23 | C22 | H27 | 109.9° | 90.0° |
C22 | C20 | O21 | 120.2° | 90.0° |
C22 | C20 | N19 | 120.1° | 90.0° |
C20 | C22 | H26 | 109.9° | 90.0° |
C20 | C22 | H27 | 110.0° | 90.0° |
N23 | C27 | C26 | 116.0° | 90.0° |
N23 | C27 | C28 | 124.0° | 90.0° |
S25 | C26 | C27 | 106.2° | 90.0° |
S25 | C26 | C31 | 133.7° | 90.0° |
C26 | C27 | C28 | 119.9° | 90.0° |
C27 | C26 | C31 | 120.0° | 90.0° |
C27 | C28 | C29 | 120.2° | 90.0° |
C27 | C28 | H28 | 119.9° | 90.0° |
O21 | C20 | N19 | 119.7° | 90.0° |
C20 | N19 | C18 | 125.8° | 90.0° |
C20 | N19 | H44 | 117.1° | 90.0° |
C26 | C31 | C30 | 119.7° | 90.0° |
C26 | C31 | H31 | 120.2° | 90.0° |
C28 | C29 | C30 | 119.3° | 90.0° |
C29 | C28 | H28 | 119.9° | 90.0° |
C28 | C29 | H29 | 120.3° | 90.0° |
C31 | C30 | C29 | 120.8° | 90.0° |
C31 | C30 | H30 | 119.6° | 90.0° |
C30 | C31 | H31 | 120.2° | 90.0° |
N19 | C18 | C17 | 108.1° | 90.0° |
N19 | C18 | H24 | 109.8° | 90.0° |
N19 | C18 | H25 | 109.8° | 90.0° |
C18 | N19 | H44 | 117.1° | 90.0° |
C30 | C29 | H29 | 120.4° | 90.0° |
C29 | C30 | H30 | 119.6° | 90.0° |
C18 | C17 | O16 | 110.5° | 90.0° |
C18 | C17 | H22 | 109.2° | 90.0° |
C18 | C17 | H23 | 109.2° | 90.0° |
C17 | C18 | H24 | 109.8° | 90.0° |
C17 | C18 | H25 | 109.8° | 90.0° |
C17 | O16 | C15 | 117.0° | 90.0° |
O16 | C17 | H22 | 109.2° | 90.0° |
O16 | C17 | H23 | 109.2° | 90.0° |
O16 | C15 | C14 | 108.6° | 90.0° |
O16 | C15 | H20 | 109.7° | 90.0° |
O16 | C15 | H21 | 109.7° | 90.0° |
O13 | C12 | C11 | 109.7° | 90.0° |
C12 | O13 | C14 | 113.8° | 90.0° |
O13 | C12 | H3 | 109.4° | 90.0° |
O13 | C12 | H4 | 109.4° | 90.0° |
C12 | C11 | O10 | 110.7° | 90.0° |
C12 | C11 | H1 | 109.2° | 90.0° |
C12 | C11 | H2 | 109.1° | 90.0° |
C11 | C12 | H3 | 109.4° | 90.0° |
C11 | C12 | H4 | 109.4° | 90.0° |
O13 | C14 | C15 | 112.1° | 90.0° |
O13 | C14 | H18 | 108.8° | 90.0° |
O13 | C14 | H19 | 108.8° | 90.0° |
C15 | C14 | H18 | 108.8° | 90.0° |
C15 | C14 | H19 | 108.8° | 90.0° |
C14 | C15 | H20 | 109.7° | 90.0° |
C14 | C15 | H21 | 109.7° | 90.0° |
C11 | O10 | C09 | 114.2° | 90.0° |
O10 | C11 | H1 | 109.2° | 90.0° |
O10 | C11 | H2 | 109.2° | 90.0° |
O10 | C09 | C08 | 112.5° | 90.0° |
O10 | C09 | H16 | 108.7° | 90.0° |
O10 | C09 | H17 | 108.7° | 90.0° |
C09 | C08 | N07 | 110.6° | 90.0° |
C09 | C08 | H14 | 109.2° | 90.0° |
C09 | C08 | H15 | 109.2° | 90.0° |
C08 | C09 | H16 | 108.7° | 90.0° |
C08 | C09 | H17 | 108.7° | 90.0° |
C08 | N07 | C05 | 124.5° | 90.0° |
N07 | C08 | H14 | 109.2° | 90.0° |
N07 | C08 | H15 | 109.2° | 90.0° |
C08 | N07 | H43 | 117.7° | 90.0° |
N07 | C05 | O06 | 120.4° | 90.0° |
N07 | C05 | C04 | 120.5° | 90.0° |
C05 | N07 | H43 | 117.7° | 90.0° |
O06 | C05 | C04 | 119.1° | 90.0° |
C05 | C04 | C03 | 113.6° | 90.0° |
C05 | C04 | H12 | 108.4° | 90.0° |
C05 | C04 | H13 | 108.4° | 90.0° |
C04 | C03 | C02 | 111.2° | 90.0° |
C04 | C03 | H10 | 109.0° | 90.0° |
C04 | C03 | H11 | 109.0° | 90.0° |
C03 | C04 | H12 | 108.4° | 90.0° |
C03 | C04 | H13 | 108.4° | 90.0° |
C03 | C02 | C01 | 111.7° | 90.0° |
C03 | C02 | H8 | 108.9° | 90.0° |
C03 | C02 | H9 | 108.9° | 90.0° |
C02 | C03 | H10 | 109.1° | 90.0° |
C02 | C03 | H11 | 109.0° | 90.0° |
C02 | C01 | H5 | 109.5° | 90.0° |
C02 | C01 | H6 | 109.5° | 90.0° |
C02 | C01 | H7 | 109.5° | 90.0° |
C01 | C02 | H8 | 108.9° | 90.0° |
C01 | C02 | H9 | 108.9° | 90.0° |
H1 | C11 | H2 | 109.5° | 90.0° |
H3 | C12 | H4 | 109.5° | 90.0° |
H5 | C01 | H6 | 109.5° | 90.0° |
H5 | C01 | H7 | 109.5° | 90.0° |
H6 | C01 | H7 | 109.5° | 90.0° |
H8 | C02 | H9 | 109.4° | 90.0° |
H10 | C03 | H11 | 109.5° | 90.0° |
H12 | C04 | H13 | 109.5° | 90.0° |
H14 | C08 | H15 | 109.5° | 90.0° |
H16 | C09 | H17 | 109.5° | 90.0° |
H18 | C14 | H19 | 109.5° | 90.0° |
H20 | C15 | H21 | 109.4° | 90.0° |
H22 | C17 | H23 | 109.5° | 90.0° |
H24 | C18 | H25 | 109.5° | 90.0° |
H26 | C22 | H27 | 109.5° | 90.0° |
H32 | C32 | H33 | 109.5° | 90.0° |
H36 | C37 | H37 | 109.5° | 90.0° |
H36 | C37 | H38 | 109.5° | 90.0° |
H37 | C37 | H38 | 109.5° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C41 | C42 | C43 | H41 | 180.0° | 90.0° |
C42 | C41 | C40 | H40 | 180.0° | 90.0° |
C41 | C42 | C43 | C38 | 0.2° | 90.0° |
C42 | C41 | C40 | C39 | 0.4° | 90.0° |
C42 | C41 | C40 | H39 | 179.6° | 90.0° |
C41 | C42 | C43 | H42 | 179.8° | 90.0° |
C43 | C42 | C41 | C40 | 0.6° | 90.0° |
C42 | C43 | C38 | H42 | 180.0° | 90.0° |
C42 | C43 | C38 | C39 | 0.4° | 90.0° |
C42 | C43 | C38 | N36 | 179.6° | 90.0° |
C43 | C42 | C41 | H40 | 179.4° | 90.0° |
C41 | C40 | C39 | H39 | 180.0° | 90.0° |
C41 | C40 | C39 | C38 | 0.2° | 90.0° |
C41 | C40 | C39 | C33 | 179.9° | 90.0° |
C40 | C41 | C42 | H41 | 179.4° | 90.0° |
C43 | C38 | C39 | C40 | 0.6° | 90.0° |
C43 | C38 | C39 | N36 | 179.2° | 90.0° |
C43 | C38 | C39 | C33 | 179.5° | 90.0° |
C43 | C38 | N36 | C37 | 0.4° | 90.0° |
C43 | C38 | N36 | C35 | 179.8° | 90.0° |
C38 | C43 | C42 | H41 | 179.8° | 90.0° |
C40 | C39 | C38 | C33 | 179.9° | 90.0° |
C40 | C39 | C38 | N36 | 179.8° | 90.0° |
C40 | C39 | C33 | C32 | 0.4° | 90.0° |
C40 | C39 | C33 | C34 | 179.5° | 90.0° |
C39 | C40 | C41 | H40 | 179.6° | 90.0° |
C39 | C38 | N36 | C37 | 179.6° | 90.0° |
C39 | C38 | N36 | C35 | 1.0° | 90.0° |
C38 | C39 | C33 | C32 | 179.5° | 90.0° |
C38 | C39 | C33 | C34 | 0.4° | 90.0° |
C38 | C39 | C40 | H39 | 179.8° | 90.0° |
C39 | C38 | C43 | H42 | 179.6° | 90.0° |
N36 | C38 | C39 | C33 | 0.3° | 90.0° |
C38 | N36 | C37 | C35 | 179.4° | 90.0° |
C38 | N36 | C35 | C34 | 1.1° | 90.0° |
C38 | N36 | C35 | H35 | 178.9° | 90.0° |
C38 | N36 | C37 | H36 | 180.0° | 90.0° |
C38 | N36 | C37 | H37 | 60.0° | 90.0° |
C38 | N36 | C37 | H38 | 60.0° | 90.0° |
N36 | C38 | C43 | H42 | 0.4° | 90.0° |
C39 | C33 | C32 | C34 | 179.1° | 90.0° |
C39 | C33 | C32 | C24 | 178.1° | 90.0° |
C39 | C33 | C34 | C35 | 0.3° | 90.0° |
C39 | C33 | C32 | H32 | 55.6° | 90.0° |
C39 | C33 | C32 | H33 | 59.4° | 90.0° |
C39 | C33 | C34 | H34 | 179.7° | 90.0° |
C33 | C39 | C40 | H39 | 0.1° | 90.0° |
C37 | N36 | C35 | C34 | 179.5° | 90.0° |
C37 | N36 | C35 | H35 | 0.5° | 90.0° |
N36 | C37 | H36 | H37 | 120.0° | 90.0° |
N36 | C37 | H36 | H38 | 120.0° | 90.0° |
N36 | C37 | H37 | H38 | 120.0° | 90.0° |
N36 | C35 | C34 | C33 | 0.4° | 90.0° |
N36 | C35 | C34 | H35 | 180.0° | 90.0° |
N36 | C35 | C34 | H34 | 179.6° | 90.0° |
C35 | N36 | C37 | H36 | 0.6° | 90.0° |
C35 | N36 | C37 | H37 | 120.6° | 90.0° |
C35 | N36 | C37 | H38 | 119.4° | 90.0° |
C33 | C32 | C24 | H32 | 122.5° | 90.0° |
C33 | C32 | C24 | H33 | 122.5° | 90.0° |
C32 | C33 | C34 | C35 | 179.5° | 90.0° |
C33 | C32 | C24 | N23 | 166.0° | 90.0° |
C33 | C32 | C24 | S25 | 15.4° | 90.0° |
C33 | C32 | H32 | H33 | 111.5° | 90.0° |
C32 | C33 | C34 | H34 | 0.5° | 90.0° |
C34 | C33 | C32 | C24 | 1.0° | 90.0° |
C33 | C34 | C35 | H34 | 180.0° | 90.0° |
C34 | C33 | C32 | H32 | 123.5° | 90.0° |
C34 | C33 | C32 | H33 | 121.4° | 90.0° |
C33 | C34 | C35 | H35 | 179.6° | 90.0° |
C32 | C24 | N23 | S25 | 178.8° | 90.0° |
C32 | C24 | N23 | C22 | 2.2° | 90.0° |
C32 | C24 | N23 | C27 | 180.0° | 90.0° |
C32 | C24 | S25 | C26 | 180.0° | 90.0° |
C24 | C32 | H32 | H33 | 111.5° | 90.0° |
C24 | N23 | C22 | C27 | 177.5° | 90.0° |
C24 | N23 | C22 | C20 | 103.5° | 90.0° |
N23 | C24 | S25 | C26 | 1.1° | 90.0° |
C24 | N23 | C27 | C26 | 0.8° | 90.0° |
C24 | N23 | C27 | C28 | 179.3° | 90.0° |
C24 | N23 | C22 | H26 | 16.2° | 90.0° |
C24 | N23 | C22 | H27 | 136.7° | 90.0° |
N23 | C24 | C32 | H32 | 43.5° | 90.0° |
N23 | C24 | C32 | H33 | 71.5° | 90.0° |
S25 | C24 | N23 | C22 | 178.9° | 90.0° |
S25 | C24 | N23 | C27 | 1.2° | 90.0° |
C24 | S25 | C26 | C27 | 0.6° | 90.0° |
C24 | S25 | C26 | C31 | 179.3° | 90.0° |
S25 | C24 | C32 | H32 | 137.8° | 90.0° |
S25 | C24 | C32 | H33 | 107.1° | 90.0° |
N23 | C22 | C20 | H26 | 119.7° | 90.0° |
N23 | C22 | C20 | H27 | 119.7° | 90.0° |
C22 | N23 | C27 | C26 | 178.8° | 90.0° |
C22 | N23 | C27 | C28 | 1.4° | 90.0° |
N23 | C22 | C20 | O21 | 105.4° | 90.0° |
N23 | C22 | C20 | N19 | 73.2° | 90.0° |
N23 | C22 | H26 | H27 | 120.8° | 90.0° |
C20 | C22 | N23 | C27 | 74.0° | 90.0° |
C22 | C20 | O21 | N19 | 178.6° | 90.0° |
C22 | C20 | N19 | C18 | 179.2° | 90.0° |
C20 | C22 | H26 | H27 | 120.9° | 90.0° |
C22 | C20 | N19 | H44 | 0.8° | 90.0° |
N23 | C27 | C26 | S25 | 0.0° | 90.0° |
N23 | C27 | C26 | C28 | 179.9° | 90.0° |
N23 | C27 | C26 | C31 | 180.0° | 90.0° |
N23 | C27 | C28 | C29 | 179.8° | 90.0° |
C27 | N23 | C22 | H26 | 166.3° | 90.0° |
C27 | N23 | C22 | H27 | 45.8° | 90.0° |
N23 | C27 | C28 | H28 | 0.1° | 90.0° |
S25 | C26 | C27 | C31 | 180.0° | 90.0° |
S25 | C26 | C27 | C28 | 179.9° | 90.0° |
S25 | C26 | C31 | C30 | 179.8° | 90.0° |
S25 | C26 | C31 | H31 | 0.2° | 90.0° |
C26 | C27 | C28 | C29 | 0.3° | 90.0° |
C27 | C26 | C31 | C30 | 0.2° | 90.0° |
C26 | C27 | C28 | H28 | 179.7° | 90.0° |
C27 | C26 | C31 | H31 | 179.8° | 90.0° |
C28 | C27 | C26 | C31 | 0.1° | 90.0° |
C27 | C28 | C29 | H28 | 180.0° | 90.0° |
C27 | C28 | C29 | C30 | 0.5° | 90.0° |
C27 | C28 | C29 | H29 | 179.5° | 90.0° |
O21 | C20 | N19 | C18 | 0.6° | 90.0° |
O21 | C20 | C22 | H26 | 14.3° | 90.0° |
O21 | C20 | C22 | H27 | 134.9° | 90.0° |
O21 | C20 | N19 | H44 | 179.4° | 90.0° |
C20 | N19 | C18 | H44 | 180.0° | 90.0° |
C20 | N19 | C18 | C17 | 176.1° | 90.0° |
C20 | N19 | C18 | H24 | 56.3° | 90.0° |
C20 | N19 | C18 | H25 | 64.1° | 90.0° |
N19 | C20 | C22 | H26 | 167.1° | 90.0° |
N19 | C20 | C22 | H27 | 46.5° | 90.0° |
C26 | C31 | C30 | H31 | 180.0° | 90.0° |
C26 | C31 | C30 | C29 | 0.4° | 90.0° |
C26 | C31 | C30 | H30 | 179.6° | 90.0° |
C28 | C29 | C30 | C31 | 0.6° | 90.0° |
C28 | C29 | C30 | H29 | 180.0° | 90.0° |
C28 | C29 | C30 | H30 | 179.4° | 90.0° |
C31 | C30 | C29 | H30 | 180.0° | 90.0° |
C31 | C30 | C29 | H29 | 179.4° | 90.0° |
N19 | C18 | C17 | H24 | 119.8° | 90.0° |
N19 | C18 | C17 | H25 | 119.8° | 90.0° |
N19 | C18 | C17 | O16 | 83.3° | 90.0° |
N19 | C18 | C17 | H22 | 36.9° | 90.0° |
N19 | C18 | C17 | H23 | 156.6° | 90.0° |
N19 | C18 | H24 | H25 | 120.6° | 90.0° |
C30 | C29 | C28 | H28 | 179.5° | 90.0° |
C29 | C30 | C31 | H31 | 179.6° | 90.0° |
C18 | C17 | O16 | H22 | 120.1° | 90.0° |
C18 | C17 | O16 | H23 | 120.2° | 90.0° |
C18 | C17 | O16 | C15 | 104.9° | 90.0° |
C18 | C17 | H22 | H23 | 119.5° | 90.0° |
C17 | C18 | H24 | H25 | 120.6° | 90.0° |
C17 | C18 | N19 | H44 | 3.9° | 90.0° |
C17 | O16 | C15 | C14 | 127.8° | 90.0° |
C17 | O16 | C15 | H20 | 112.4° | 90.0° |
C17 | O16 | C15 | H21 | 7.9° | 90.0° |
O16 | C17 | H22 | H23 | 119.5° | 90.0° |
O16 | C17 | C18 | H24 | 156.9° | 90.0° |
O16 | C17 | C18 | H25 | 36.5° | 90.0° |
O16 | C15 | C14 | O13 | 158.6° | 90.0° |
O16 | C15 | C14 | H20 | 119.9° | 90.0° |
O16 | C15 | C14 | H21 | 119.9° | 90.0° |
O16 | C15 | C14 | H18 | 38.3° | 90.0° |
O16 | C15 | C14 | H19 | 81.0° | 90.0° |
O16 | C15 | H20 | H21 | 120.4° | 90.0° |
C15 | O16 | C17 | H22 | 135.0° | 90.0° |
C15 | O16 | C17 | H23 | 15.3° | 90.0° |
O13 | C12 | C11 | H3 | 120.0° | 90.0° |
O13 | C12 | C11 | H4 | 120.1° | 90.0° |
C12 | O13 | C14 | C15 | 135.1° | 90.0° |
O13 | C12 | C11 | O10 | 149.0° | 90.0° |
O13 | C12 | C11 | H1 | 28.9° | 90.0° |
O13 | C12 | C11 | H2 | 90.8° | 90.0° |
O13 | C12 | H3 | H4 | 119.9° | 90.0° |
C12 | O13 | C14 | H18 | 14.7° | 90.0° |
C12 | O13 | C14 | H19 | 104.5° | 90.0° |
C11 | C12 | O13 | C14 | 173.3° | 90.0° |
C12 | C11 | O10 | H1 | 120.2° | 90.0° |
C12 | C11 | O10 | H2 | 120.2° | 90.0° |
C12 | C11 | O10 | C09 | 172.8° | 90.0° |
C12 | C11 | H1 | H2 | 119.4° | 90.0° |
C11 | C12 | H3 | H4 | 119.9° | 90.0° |
O13 | C14 | C15 | H18 | 120.4° | 90.0° |
O13 | C14 | C15 | H19 | 120.4° | 90.0° |
C14 | O13 | C12 | H3 | 66.7° | 90.0° |
C14 | O13 | C12 | H4 | 53.2° | 90.0° |
O13 | C14 | H18 | H19 | 118.8° | 90.0° |
O13 | C14 | C15 | H20 | 38.7° | 90.0° |
O13 | C14 | C15 | H21 | 81.5° | 90.0° |
C15 | C14 | H18 | H19 | 118.8° | 90.0° |
C14 | C15 | H20 | H21 | 120.4° | 90.0° |
C11 | O10 | C09 | C08 | 114.4° | 90.0° |
O10 | C11 | H1 | H2 | 119.5° | 90.0° |
O10 | C11 | C12 | H3 | 90.9° | 90.0° |
O10 | C11 | C12 | H4 | 29.0° | 90.0° |
C11 | O10 | C09 | H16 | 6.1° | 90.0° |
C11 | O10 | C09 | H17 | 125.2° | 90.0° |
O10 | C09 | C08 | H16 | 120.4° | 90.0° |
O10 | C09 | C08 | H17 | 120.4° | 90.0° |
O10 | C09 | C08 | N07 | 176.7° | 90.0° |
C09 | O10 | C11 | H1 | 52.7° | 90.0° |
C09 | O10 | C11 | H2 | 67.0° | 90.0° |
O10 | C09 | C08 | H14 | 56.6° | 90.0° |
O10 | C09 | C08 | H15 | 63.1° | 90.0° |
O10 | C09 | H16 | H17 | 118.6° | 90.0° |
C09 | C08 | N07 | H14 | 120.1° | 90.0° |
C09 | C08 | N07 | H15 | 120.1° | 90.0° |
C09 | C08 | N07 | C05 | 167.4° | 90.0° |
C09 | C08 | H14 | H15 | 119.5° | 90.0° |
C08 | C09 | H16 | H17 | 118.6° | 90.0° |
C09 | C08 | N07 | H43 | 12.6° | 90.0° |
C08 | N07 | C05 | H43 | 180.0° | 90.0° |
C08 | N07 | C05 | O06 | 0.8° | 90.0° |
C08 | N07 | C05 | C04 | 180.0° | 90.0° |
N07 | C08 | H14 | H15 | 119.5° | 90.0° |
N07 | C08 | C09 | H16 | 62.9° | 90.0° |
N07 | C08 | C09 | H17 | 56.3° | 90.0° |
N07 | C05 | O06 | C04 | 179.2° | 90.0° |
N07 | C05 | C04 | C03 | 144.0° | 90.0° |
N07 | C05 | C04 | H12 | 23.4° | 90.0° |
N07 | C05 | C04 | H13 | 95.4° | 90.0° |
C05 | N07 | C08 | H14 | 47.3° | 90.0° |
C05 | N07 | C08 | H15 | 72.4° | 90.0° |
O06 | C05 | C04 | C03 | 35.3° | 90.0° |
O06 | C05 | C04 | H12 | 155.9° | 90.0° |
O06 | C05 | C04 | H13 | 85.3° | 90.0° |
O06 | C05 | N07 | H43 | 179.1° | 90.0° |
C05 | C04 | C03 | H12 | 120.6° | 90.0° |
C05 | C04 | C03 | H13 | 120.6° | 90.0° |
C05 | C04 | C03 | C02 | 107.8° | 90.0° |
C05 | C04 | C03 | H10 | 12.5° | 90.0° |
C05 | C04 | C03 | H11 | 132.0° | 90.0° |
C05 | C04 | H12 | H13 | 118.1° | 90.0° |
C04 | C05 | N07 | H43 | 0.1° | 90.0° |
C04 | C03 | C02 | H10 | 120.3° | 90.0° |
C04 | C03 | C02 | H11 | 120.3° | 90.0° |
C04 | C03 | C02 | C01 | 143.1° | 90.0° |
C04 | C03 | C02 | H8 | 22.7° | 90.0° |
C04 | C03 | C02 | H9 | 96.6° | 90.0° |
C04 | C03 | H10 | H11 | 119.2° | 90.0° |
C03 | C04 | H12 | H13 | 118.1° | 90.0° |
C03 | C02 | C01 | H8 | 120.4° | 90.0° |
C03 | C02 | C01 | H9 | 120.3° | 90.0° |
C03 | C02 | C01 | H5 | 180.0° | 90.0° |
C03 | C02 | C01 | H6 | 60.0° | 90.0° |
C03 | C02 | C01 | H7 | 60.0° | 90.0° |
C03 | C02 | H8 | H9 | 119.0° | 90.0° |
C02 | C03 | H10 | H11 | 119.2° | 90.0° |
C02 | C03 | C04 | H12 | 131.6° | 90.0° |
C02 | C03 | C04 | H13 | 12.8° | 90.0° |
C02 | C01 | H5 | H6 | 120.0° | 90.0° |
C02 | C01 | H5 | H7 | 120.0° | 90.0° |
C02 | C01 | H6 | H7 | 120.0° | 90.0° |
C01 | C02 | H8 | H9 | 119.0° | 90.0° |
C01 | C02 | C03 | H10 | 96.7° | 90.0° |
C01 | C02 | C03 | H11 | 22.8° | 90.0° |
H1 | C11 | C12 | H3 | 148.9° | 90.0° |
H1 | C11 | C12 | H4 | 91.2° | 90.0° |
H2 | C11 | C12 | H3 | 29.3° | 90.0° |
H2 | C11 | C12 | H4 | 149.2° | 90.0° |
H5 | C01 | H6 | H7 | 120.0° | 90.0° |
H5 | C01 | C02 | H8 | 59.7° | 90.0° |
H5 | C01 | C02 | H9 | 59.7° | 90.0° |
H6 | C01 | C02 | H8 | 179.6° | 90.0° |
H6 | C01 | C02 | H9 | 60.3° | 90.0° |
H7 | C01 | C02 | H8 | 60.4° | 90.0° |
H7 | C01 | C02 | H9 | 179.7° | 90.0° |
H8 | C02 | C03 | H10 | 143.0° | 90.0° |
H8 | C02 | C03 | H11 | 97.6° | 90.0° |
H9 | C02 | C03 | H10 | 23.7° | 90.0° |
H9 | C02 | C03 | H11 | 143.1° | 90.0° |
H10 | C03 | C04 | H12 | 108.1° | 90.0° |
H10 | C03 | C04 | H13 | 133.1° | 90.0° |
H11 | C03 | C04 | H12 | 11.4° | 90.0° |
H11 | C03 | C04 | H13 | 107.4° | 90.0° |
H14 | C08 | C09 | H16 | 177.0° | 90.0° |
H14 | C08 | C09 | H17 | 63.9° | 90.0° |
H14 | C08 | N07 | H43 | 132.7° | 90.0° |
H15 | C08 | C09 | H16 | 57.3° | 90.0° |
H15 | C08 | C09 | H17 | 176.4° | 90.0° |
H15 | C08 | N07 | H43 | 107.5° | 90.0° |
H18 | C14 | C15 | H20 | 81.6° | 90.0° |
H18 | C14 | C15 | H21 | 158.1° | 90.0° |
H19 | C14 | C15 | H20 | 159.1° | 90.0° |
H19 | C14 | C15 | H21 | 38.9° | 90.0° |
H22 | C17 | C18 | H24 | 82.9° | 90.0° |
H22 | C17 | C18 | H25 | 156.7° | 90.0° |
H23 | C17 | C18 | H24 | 36.8° | 90.0° |
H23 | C17 | C18 | H25 | 83.7° | 90.0° |
H24 | C18 | N19 | H44 | 123.7° | 90.0° |
H25 | C18 | N19 | H44 | 115.9° | 90.0° |
H28 | C28 | C29 | H29 | 0.5° | 90.0° |
H29 | C29 | C30 | H30 | 0.6° | 90.0° |
H30 | C30 | C31 | H31 | 0.5° | 90.0° |
H34 | C34 | C35 | H35 | 0.4° | 90.0° |
H36 | C37 | H37 | H38 | 120.0° | 90.0° |
H39 | C40 | C41 | H40 | 0.4° | 90.0° |
H40 | C41 | C42 | H41 | 0.6° | 90.0° |
H41 | C42 | C43 | H42 | 0.2° | 90.0° |