XO7
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C01 | C02 | sing | 1.53Å | 1.55Å | |
F14 | C13 | sing | 1.40Å | 1.37Å | |
C02 | C03 | sing | 1.53Å | 1.53Å | |
F16 | C13 | sing | 1.40Å | 1.36Å | |
C13 | O12 | sing | 1.43Å | 1.39Å | |
C13 | F15 | sing | 1.40Å | 1.35Å | |
C03 | C04 | sing | 1.53Å | 1.62Å | |
N25 | C24 | sing | 1.34Å | 1.33Å | Aromatic |
N25 | C26 | doub | 1.30Å | 1.32Å | Aromatic |
O12 | C11 | sing | 1.36Å | 1.40Å | |
C24 | C23 | doub | 1.35Å | 1.40Å | Aromatic |
C05 | C04 | sing | 1.53Å | 1.49Å | |
C05 | N06 | sing | 1.46Å | 1.47Å | |
C11 | C10 | doub | 1.39Å | 1.41Å | Aromatic |
C11 | C17 | sing | 1.39Å | 1.39Å | Aromatic |
C10 | C09 | sing | 1.38Å | 1.38Å | Aromatic |
C04 | N21 | sing | 1.47Å | 1.40Å | |
C17 | C07 | doub | 1.39Å | 1.38Å | Aromatic |
C09 | C08 | doub | 1.38Å | 1.40Å | Aromatic |
C07 | C08 | sing | 1.39Å | 1.41Å | Aromatic |
C07 | N06 | sing | 1.40Å | 1.48Å | |
C26 | N27 | sing | 1.35Å | 1.34Å | Aromatic |
N06 | C18 | sing | 1.34Å | 1.47Å | |
C23 | C22 | sing | 1.51Å | 1.55Å | |
C23 | N27 | sing | 1.37Å | 1.32Å | Aromatic |
N21 | C22 | sing | 1.47Å | 1.30Å | |
N21 | C20 | sing | 1.47Å | 1.35Å | |
N27 | C28 | sing | 1.47Å | 1.45Å | |
C35 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
C35 | C29 | sing | 1.38Å | 1.42Å | Aromatic |
C34 | C32 | sing | 1.38Å | 1.41Å | Aromatic |
C18 | C20 | sing | 1.50Å | 1.61Å | |
C18 | O19 | doub | 1.21Å | 1.17Å | |
C28 | C29 | sing | 1.51Å | 1.52Å | |
C29 | C30 | doub | 1.38Å | 1.40Å | Aromatic |
C32 | BR33 | sing | 1.89Å | 1.93Å | |
C32 | C31 | doub | 1.38Å | 1.41Å | Aromatic |
C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
C10 | H1 | sing | 1.08Å | 1.08Å | |
C17 | H2 | sing | 1.08Å | 1.08Å | |
C20 | H3 | sing | 1.09Å | 1.10Å | |
C20 | H4 | sing | 1.09Å | 1.10Å | |
C22 | H5 | sing | 1.09Å | 1.10Å | |
C22 | H6 | sing | 1.09Å | 1.10Å | |
C24 | H7 | sing | 1.08Å | 1.08Å | |
C26 | H8 | sing | 1.08Å | 1.08Å | |
C28 | H9 | sing | 1.09Å | 1.10Å | |
C28 | H10 | sing | 1.09Å | 1.10Å | |
C01 | H11 | sing | 1.09Å | 1.10Å | |
C01 | H12 | sing | 1.09Å | 1.10Å | |
C01 | H13 | sing | 1.09Å | 1.10Å | |
C02 | H14 | sing | 1.09Å | 1.10Å | |
C02 | H15 | sing | 1.09Å | 1.10Å | |
C03 | H16 | sing | 1.09Å | 1.10Å | |
C03 | H17 | sing | 1.09Å | 1.10Å | |
C04 | H18 | sing | 1.09Å | 1.10Å | |
C05 | H19 | sing | 1.09Å | 1.10Å | |
C05 | H20 | sing | 1.09Å | 1.10Å | |
C08 | H21 | sing | 1.08Å | 1.08Å | |
C09 | H22 | sing | 1.08Å | 1.08Å | |
C30 | H23 | sing | 1.08Å | 1.08Å | |
C31 | H24 | sing | 1.08Å | 1.08Å | |
C34 | H25 | sing | 1.08Å | 1.08Å | |
C35 | H26 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C01 | C02 | C03 | 113.1° | 109.5° |
C02 | C01 | H11 | 109.5° | 109.5° |
C02 | C01 | H12 | 109.5° | 109.5° |
C02 | C01 | H13 | 109.5° | 109.5° |
C01 | C02 | H14 | 108.5° | 109.5° |
C01 | C02 | H15 | 108.5° | 109.5° |
F14 | C13 | F16 | 107.6° | 109.4° |
F14 | C13 | O12 | 110.1° | 109.4° |
F14 | C13 | F15 | 110.2° | 109.4° |
C02 | C03 | C04 | 112.6° | 109.5° |
C03 | C02 | H14 | 108.6° | 109.4° |
C03 | C02 | H15 | 108.5° | 109.4° |
C02 | C03 | H16 | 108.7° | 109.5° |
C02 | C03 | H17 | 108.7° | 109.5° |
F16 | C13 | O12 | 108.7° | 109.5° |
F16 | C13 | F15 | 108.6° | 109.5° |
O12 | C13 | F15 | 111.6° | 109.5° |
C13 | O12 | C11 | 120.0° | 117.0° |
C03 | C04 | C05 | 111.4° | 109.6° |
C03 | C04 | N21 | 110.8° | 109.6° |
C04 | C03 | H16 | 108.7° | 109.5° |
C04 | C03 | H17 | 108.7° | 109.5° |
C03 | C04 | H18 | 106.8° | 109.6° |
C24 | N25 | C26 | 108.9° | 109.3° |
N25 | C24 | C23 | 107.6° | 108.0° |
N25 | C24 | H7 | 126.2° | 126.0° |
N25 | C26 | N27 | 108.3° | 108.7° |
N25 | C26 | H8 | 125.9° | 125.7° |
O12 | C11 | C10 | 118.8° | 120.0° |
O12 | C11 | C17 | 122.3° | 120.1° |
C24 | C23 | C22 | 126.9° | 126.6° |
C24 | C23 | N27 | 105.6° | 106.8° |
C23 | C24 | H7 | 126.2° | 126.0° |
C04 | C05 | N06 | 115.5° | 110.0° |
C05 | C04 | N21 | 110.0° | 108.7° |
C05 | C04 | H18 | 108.4° | 109.7° |
C04 | C05 | H19 | 107.9° | 109.4° |
C04 | C05 | H20 | 108.0° | 109.4° |
C05 | N06 | C07 | 120.6° | 118.5° |
C05 | N06 | C18 | 116.9° | 122.9° |
N06 | C05 | H19 | 108.0° | 109.2° |
N06 | C05 | H20 | 107.9° | 109.5° |
C10 | C11 | C17 | 118.9° | 120.0° |
C11 | C10 | C09 | 120.6° | 120.1° |
C11 | C10 | H1 | 119.7° | 120.0° |
C11 | C17 | C07 | 121.0° | 119.9° |
C11 | C17 | H2 | 119.5° | 120.1° |
C10 | C09 | C08 | 120.2° | 120.1° |
C09 | C10 | H1 | 119.7° | 119.9° |
C10 | C09 | H22 | 119.9° | 119.9° |
C04 | N21 | C22 | 113.4° | 111.0° |
C04 | N21 | C20 | 115.2° | 110.1° |
N21 | C04 | H18 | 109.5° | 109.6° |
C17 | C07 | C08 | 119.8° | 119.9° |
C17 | C07 | N06 | 118.7° | 120.1° |
C07 | C17 | H2 | 119.5° | 120.0° |
C09 | C08 | C07 | 119.6° | 120.0° |
C09 | C08 | H21 | 120.2° | 120.0° |
C08 | C09 | H22 | 119.9° | 119.9° |
C08 | C07 | N06 | 121.4° | 120.0° |
C07 | C08 | H21 | 120.2° | 120.0° |
C07 | N06 | C18 | 122.5° | 118.5° |
C26 | N27 | C23 | 109.6° | 107.3° |
C26 | N27 | C28 | 124.9° | 126.4° |
N27 | C26 | H8 | 125.8° | 125.6° |
N06 | C18 | C20 | 116.3° | 122.7° |
N06 | C18 | O19 | 121.9° | 118.6° |
C22 | C23 | N27 | 127.5° | 126.6° |
C23 | C22 | N21 | 109.3° | 109.5° |
C23 | C22 | H5 | 109.5° | 109.5° |
C23 | C22 | H6 | 109.5° | 109.5° |
C23 | N27 | C28 | 125.4° | 126.3° |
C22 | N21 | C20 | 112.4° | 111.1° |
N21 | C22 | H5 | 109.5° | 109.5° |
N21 | C22 | H6 | 109.5° | 109.5° |
N21 | C20 | C18 | 116.2° | 109.9° |
N21 | C20 | H3 | 107.8° | 109.4° |
N21 | C20 | H4 | 107.7° | 109.4° |
N27 | C28 | C29 | 110.2° | 109.4° |
N27 | C28 | H9 | 109.3° | 109.5° |
N27 | C28 | H10 | 109.3° | 109.5° |
C34 | C35 | C29 | 119.0° | 120.0° |
C35 | C34 | C32 | 119.3° | 120.0° |
C35 | C34 | H25 | 120.3° | 120.0° |
C34 | C35 | H26 | 120.5° | 120.0° |
C35 | C29 | C28 | 121.7° | 120.0° |
C35 | C29 | C30 | 121.1° | 120.0° |
C29 | C35 | H26 | 120.5° | 120.0° |
C34 | C32 | BR33 | 121.8° | 120.0° |
C34 | C32 | C31 | 121.3° | 120.0° |
C32 | C34 | H25 | 120.4° | 120.0° |
C20 | C18 | O19 | 121.8° | 118.7° |
C18 | C20 | H3 | 107.7° | 109.4° |
C18 | C20 | H4 | 107.8° | 109.4° |
C28 | C29 | C30 | 117.3° | 120.0° |
C29 | C28 | H9 | 109.3° | 109.5° |
C29 | C28 | H10 | 109.3° | 109.5° |
C29 | C30 | C31 | 119.8° | 120.0° |
C29 | C30 | H23 | 120.1° | 120.0° |
BR33 | C32 | C31 | 116.9° | 120.0° |
C32 | C31 | C30 | 119.6° | 120.0° |
C32 | C31 | H24 | 120.2° | 120.0° |
C31 | C30 | H23 | 120.1° | 120.0° |
C30 | C31 | H24 | 120.2° | 120.0° |
H3 | C20 | H4 | 109.5° | 109.3° |
H5 | C22 | H6 | 109.4° | 109.5° |
H9 | C28 | H10 | 109.5° | 109.5° |
H11 | C01 | H12 | 109.5° | 109.4° |
H11 | C01 | H13 | 109.4° | 109.5° |
H12 | C01 | H13 | 109.4° | 109.4° |
H14 | C02 | H15 | 109.5° | 109.6° |
H16 | C03 | H17 | 109.5° | 109.5° |
H19 | C05 | H20 | 109.5° | 109.3° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C01 | C02 | C03 | H14 | 120.6° | 120.0° |
C01 | C02 | C03 | H15 | 120.5° | 120.0° |
C01 | C02 | C03 | C04 | 141.4° | 175.0° |
C02 | C01 | H11 | H12 | 120.0° | 120.0° |
C02 | C01 | H11 | H13 | 120.0° | 120.0° |
C02 | C01 | H12 | H13 | 120.0° | 120.0° |
C01 | C02 | H14 | H15 | 118.3° | 120.0° |
C01 | C02 | C03 | H16 | 98.1° | 55.0° |
C01 | C02 | C03 | H17 | 20.9° | 65.0° |
F14 | C13 | F16 | O12 | 119.2° | 120.0° |
F14 | C13 | F16 | F15 | 119.2° | 119.9° |
F14 | C13 | O12 | F15 | 122.7° | 120.0° |
F14 | C13 | O12 | C11 | 58.4° | 180.0° |
C02 | C03 | C04 | H16 | 120.5° | 120.0° |
C02 | C03 | C04 | H17 | 120.5° | 120.0° |
C02 | C03 | C04 | C05 | 39.6° | 176.9° |
C02 | C03 | C04 | N21 | 162.3° | 63.9° |
C03 | C02 | C01 | H11 | 180.0° | 60.0° |
C03 | C02 | C01 | H12 | 60.0° | 60.0° |
C03 | C02 | C01 | H13 | 60.0° | 180.0° |
C03 | C02 | H14 | H15 | 118.3° | 120.0° |
C02 | C03 | H16 | H17 | 118.6° | 120.0° |
C02 | C03 | C04 | H18 | 78.5° | 56.4° |
F16 | C13 | O12 | F15 | 119.7° | 120.1° |
F16 | C13 | O12 | C11 | 176.0° | 60.0° |
C13 | O12 | C11 | C10 | 170.0° | 0.1° |
C13 | O12 | C11 | C17 | 10.3° | 180.0° |
F15 | C13 | O12 | C11 | 64.2° | 60.1° |
C03 | C04 | C05 | N21 | 123.2° | 119.7° |
C03 | C04 | C05 | H18 | 117.2° | 120.4° |
C03 | C04 | C05 | N06 | 69.7° | 170.2° |
C03 | C04 | N21 | H18 | 117.5° | 120.3° |
C03 | C04 | N21 | C22 | 72.2° | 65.4° |
C03 | C04 | N21 | C20 | 59.3° | 171.1° |
C04 | C03 | C02 | H14 | 20.9° | 65.0° |
C04 | C03 | C02 | H15 | 98.1° | 55.1° |
C04 | C03 | H16 | H17 | 118.6° | 120.0° |
C03 | C04 | C05 | H19 | 169.4° | 69.8° |
C03 | C04 | C05 | H20 | 51.2° | 49.9° |
N25 | C24 | C23 | H7 | 180.0° | 179.7° |
C24 | N25 | C26 | N27 | 0.1° | 0.3° |
N25 | C24 | C23 | C22 | 179.9° | 179.8° |
N25 | C24 | C23 | N27 | 0.7° | 0.2° |
C24 | N25 | C26 | H8 | 179.8° | 179.8° |
C26 | N25 | C24 | C23 | 0.5° | 0.0° |
N25 | C26 | N27 | H8 | 180.0° | 179.5° |
N25 | C26 | N27 | C23 | 0.4° | 0.4° |
N25 | C26 | N27 | C28 | 178.9° | 179.9° |
C26 | N25 | C24 | H7 | 179.4° | 179.7° |
O12 | C11 | C10 | C17 | 179.7° | 179.9° |
O12 | C11 | C10 | C09 | 179.8° | 180.0° |
O12 | C11 | C17 | C07 | 179.8° | 180.0° |
O12 | C11 | C10 | H1 | 0.2° | 0.4° |
O12 | C11 | C17 | H2 | 0.2° | 0.3° |
C24 | C23 | N27 | C26 | 0.7° | 0.4° |
C24 | C23 | C22 | N27 | 178.9° | 179.9° |
C24 | C23 | C22 | N21 | 98.7° | 25.8° |
C24 | C23 | N27 | C28 | 179.3° | 180.0° |
C24 | C23 | C22 | H5 | 21.3° | 94.2° |
C24 | C23 | C22 | H6 | 141.3° | 145.8° |
C04 | C05 | N06 | H19 | 120.9° | 120.0° |
C04 | C05 | N06 | H20 | 120.9° | 120.3° |
C05 | C04 | N21 | H18 | 119.0° | 120.0° |
C04 | C05 | N06 | C07 | 157.9° | 161.8° |
C04 | C05 | N06 | C18 | 22.3° | 18.3° |
C05 | C04 | N21 | C22 | 164.3° | 54.3° |
C05 | C04 | N21 | C20 | 64.2° | 69.2° |
C05 | C04 | C03 | H16 | 80.8° | 56.9° |
C05 | C04 | C03 | H17 | 160.1° | 63.1° |
C04 | C05 | H19 | H20 | 117.3° | 119.8° |
N06 | C05 | C04 | N21 | 53.5° | 50.5° |
C05 | N06 | C07 | C17 | 54.0° | 111.4° |
C05 | N06 | C07 | C08 | 125.4° | 68.5° |
C05 | N06 | C07 | C18 | 179.8° | 179.9° |
C05 | N06 | C18 | C20 | 0.1° | 1.7° |
C05 | N06 | C18 | O19 | 179.9° | 178.2° |
N06 | C05 | C04 | H18 | 173.2° | 69.4° |
N06 | C05 | H19 | H20 | 117.2° | 119.8° |
C11 | C10 | C09 | H1 | 180.0° | 179.6° |
C10 | C11 | C17 | C07 | 0.1° | 0.1° |
C11 | C10 | C09 | C08 | 0.3° | 0.3° |
C10 | C11 | C17 | H2 | 179.9° | 179.8° |
C11 | C10 | C09 | H22 | 179.7° | 179.7° |
C17 | C11 | C10 | C09 | 0.1° | 0.1° |
C11 | C17 | C07 | H2 | 180.0° | 179.7° |
C11 | C17 | C07 | C08 | 0.3° | 0.3° |
C11 | C17 | C07 | N06 | 179.6° | 179.7° |
C17 | C11 | C10 | H1 | 179.9° | 179.7° |
C10 | C09 | C08 | H22 | 180.0° | 180.0° |
C10 | C09 | C08 | C07 | 0.7° | 0.5° |
C10 | C09 | C08 | H21 | 179.3° | 180.0° |
C04 | N21 | C22 | C23 | 76.3° | 163.9° |
C04 | N21 | C22 | C20 | 132.8° | 122.9° |
C04 | N21 | C20 | C18 | 41.3° | 50.3° |
C04 | N21 | C20 | H3 | 79.6° | 69.9° |
C04 | N21 | C20 | H4 | 162.3° | 170.4° |
C04 | N21 | C22 | H5 | 43.7° | 43.9° |
C04 | N21 | C22 | H6 | 163.7° | 76.1° |
N21 | C04 | C03 | H16 | 41.9° | 176.1° |
N21 | C04 | C03 | H17 | 77.2° | 56.1° |
N21 | C04 | C05 | H19 | 67.4° | 170.4° |
N21 | C04 | C05 | H20 | 174.3° | 69.8° |
C17 | C07 | C08 | C09 | 0.7° | 0.5° |
C17 | C07 | C08 | N06 | 179.3° | 179.9° |
C17 | C07 | N06 | C18 | 125.9° | 68.7° |
C17 | C07 | C08 | H21 | 179.3° | 180.0° |
C09 | C08 | C07 | H21 | 180.0° | 179.5° |
C09 | C08 | C07 | N06 | 180.0° | 179.4° |
C08 | C09 | C10 | H1 | 179.7° | 179.9° |
C08 | C07 | N06 | C18 | 54.8° | 111.4° |
C08 | C07 | C17 | H2 | 179.7° | 180.0° |
C07 | C08 | C09 | H22 | 179.3° | 179.5° |
C07 | N06 | C18 | C20 | 179.8° | 178.4° |
C07 | N06 | C18 | O19 | 0.3° | 1.7° |
N06 | C07 | C17 | H2 | 0.3° | 0.0° |
C07 | N06 | C05 | H19 | 81.3° | 41.7° |
C07 | N06 | C05 | H20 | 37.0° | 78.0° |
N06 | C07 | C08 | H21 | 0.0° | 0.0° |
C26 | N27 | C23 | C22 | 179.8° | 179.7° |
C26 | N27 | C23 | C28 | 178.6° | 179.6° |
C26 | N27 | C28 | C29 | 109.1° | 93.9° |
C26 | N27 | C28 | H9 | 130.7° | 146.1° |
C26 | N27 | C28 | H10 | 11.0° | 26.0° |
N06 | C18 | C20 | N21 | 8.5° | 17.2° |
N06 | C18 | C20 | O19 | 180.0° | 180.0° |
N06 | C18 | C20 | H3 | 112.5° | 103.0° |
N06 | C18 | C20 | H4 | 129.4° | 137.3° |
C18 | N06 | C05 | H19 | 98.6° | 138.4° |
C18 | N06 | C05 | H20 | 143.2° | 101.9° |
C23 | C22 | N21 | H5 | 120.0° | 120.0° |
C23 | C22 | N21 | H6 | 120.0° | 120.0° |
C23 | C22 | N21 | C20 | 150.8° | 73.2° |
C22 | C23 | N27 | C28 | 1.6° | 0.0° |
C23 | C22 | H5 | H6 | 120.1° | 120.0° |
C22 | C23 | C24 | H7 | 0.1° | 0.1° |
N27 | C23 | C22 | N21 | 80.2° | 154.1° |
C23 | N27 | C28 | C29 | 72.5° | 85.6° |
N27 | C23 | C22 | H5 | 159.8° | 85.9° |
N27 | C23 | C22 | H6 | 39.8° | 34.1° |
N27 | C23 | C24 | H7 | 179.2° | 179.9° |
C23 | N27 | C26 | H8 | 179.7° | 180.0° |
C23 | N27 | C28 | H9 | 47.6° | 34.4° |
C23 | N27 | C28 | H10 | 167.4° | 154.4° |
C22 | N21 | C20 | C18 | 173.3° | 73.2° |
C22 | N21 | C20 | H3 | 52.3° | 166.7° |
C22 | N21 | C20 | H4 | 65.8° | 47.0° |
N21 | C22 | H5 | H6 | 120.1° | 120.0° |
C22 | N21 | C04 | H18 | 45.3° | 174.3° |
N21 | C20 | C18 | H3 | 121.0° | 120.2° |
N21 | C20 | C18 | H4 | 121.0° | 120.1° |
N21 | C20 | C18 | O19 | 171.6° | 162.8° |
N21 | C20 | H3 | H4 | 116.9° | 119.7° |
C20 | N21 | C22 | H5 | 89.2° | 166.8° |
C20 | N21 | C22 | H6 | 30.8° | 46.8° |
C20 | N21 | C04 | H18 | 176.8° | 50.8° |
N27 | C28 | C29 | C35 | 36.5° | 90.2° |
N27 | C28 | C29 | H9 | 120.1° | 120.0° |
N27 | C28 | C29 | H10 | 120.1° | 120.0° |
N27 | C28 | C29 | C30 | 143.7° | 90.2° |
C28 | N27 | C26 | H8 | 1.1° | 0.4° |
N27 | C28 | H9 | H10 | 119.7° | 120.0° |
C34 | C35 | C29 | H26 | 180.0° | 179.4° |
C35 | C34 | C32 | H25 | 180.0° | 179.8° |
C34 | C35 | C29 | C28 | 179.8° | 179.8° |
C34 | C35 | C29 | C30 | 0.0° | 0.6° |
C35 | C34 | C32 | BR33 | 179.4° | 179.7° |
C35 | C34 | C32 | C31 | 0.4° | 0.2° |
C29 | C35 | C34 | C32 | 0.2° | 0.5° |
C35 | C29 | C28 | C30 | 179.8° | 179.6° |
C35 | C29 | C30 | C31 | 0.1° | 0.3° |
C35 | C29 | C28 | H9 | 156.6° | 29.8° |
C35 | C29 | C28 | H10 | 83.6° | 149.9° |
C35 | C29 | C30 | H23 | 179.9° | 179.8° |
C29 | C35 | C34 | H25 | 179.8° | 179.7° |
C34 | C32 | BR33 | C31 | 179.9° | 179.9° |
C34 | C32 | C31 | C30 | 0.5° | 0.1° |
C34 | C32 | C31 | H24 | 179.5° | 180.0° |
C32 | C34 | C35 | H26 | 179.8° | 179.9° |
C18 | C20 | H3 | H4 | 116.9° | 119.8° |
O19 | C18 | C20 | H3 | 67.4° | 77.1° |
O19 | C18 | C20 | H4 | 50.6° | 42.7° |
C28 | C29 | C30 | C31 | 179.9° | 180.0° |
C29 | C28 | H9 | H10 | 119.6° | 120.0° |
C28 | C29 | C30 | H23 | 0.1° | 0.1° |
C28 | C29 | C35 | H26 | 0.2° | 0.3° |
C29 | C30 | C31 | C32 | 0.4° | 0.0° |
C29 | C30 | C31 | H23 | 180.0° | 179.9° |
C30 | C29 | C28 | H9 | 23.6° | 149.8° |
C30 | C29 | C28 | H10 | 96.2° | 29.8° |
C29 | C30 | C31 | H24 | 179.6° | 179.9° |
C30 | C29 | C35 | H26 | 180.0° | 180.0° |
BR33 | C32 | C31 | C30 | 179.3° | 180.0° |
BR33 | C32 | C31 | H24 | 0.7° | 0.1° |
BR33 | C32 | C34 | H25 | 0.6° | 0.1° |
C32 | C31 | C30 | H24 | 180.0° | 179.9° |
C32 | C31 | C30 | H23 | 179.6° | 179.9° |
C31 | C32 | C34 | H25 | 179.6° | 180.0° |
H1 | C10 | C09 | H22 | 0.3° | 0.1° |
H11 | C01 | H12 | H13 | 120.0° | 120.0° |
H11 | C01 | C02 | H14 | 59.5° | 60.0° |
H11 | C01 | C02 | H15 | 59.4° | 179.9° |
H12 | C01 | C02 | H14 | 60.6° | 179.9° |
H12 | C01 | C02 | H15 | 179.5° | 60.0° |
H13 | C01 | C02 | H14 | 179.4° | 60.1° |
H13 | C01 | C02 | H15 | 60.5° | 60.0° |
H14 | C02 | C03 | H16 | 141.3° | 175.0° |
H14 | C02 | C03 | H17 | 99.6° | 55.0° |
H15 | C02 | C03 | H16 | 22.4° | 64.9° |
H15 | C02 | C03 | H17 | 141.5° | 175.0° |
H16 | C03 | C04 | H18 | 161.0° | 63.5° |
H17 | C03 | C04 | H18 | 41.9° | 176.4° |
H18 | C04 | C05 | H19 | 52.3° | 50.6° |
H18 | C04 | C05 | H20 | 66.0° | 170.3° |
H21 | C08 | C09 | H22 | 0.7° | 0.0° |
H23 | C30 | C31 | H24 | 0.4° | 0.0° |
H25 | C34 | C35 | H26 | 0.2° | 0.2° |