57C
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C26 | C5 | sing | 1.51Å | 1.50Å | |
C25 | C9 | sing | 1.55Å | 1.52Å | |
C25 | C24 | sing | 1.55Å | 1.52Å | |
C9 | C10 | sing | 1.50Å | 1.52Å | |
C24 | N21 | sing | 1.43Å | 1.46Å | |
C5 | N6 | sing | 1.34Å | 1.34Å | Aromatic |
C5 | C4 | doub | 1.39Å | 1.48Å | Aromatic |
N6 | C7 | sing | 1.38Å | 1.34Å | Aromatic |
O9 | C8 | doub | 1.22Å | 1.22Å | |
O28 | C27 | doub | 1.21Å | 1.22Å | |
C4 | C27 | sing | 1.47Å | 1.50Å | |
C4 | C3 | sing | 1.42Å | 1.39Å | Aromatic |
C27 | C29 | sing | 1.51Å | 1.50Å | |
C10 | C23 | sing | 1.53Å | 1.53Å | |
C7 | C8 | sing | 1.47Å | 1.50Å | |
C7 | C3 | doub | 1.36Å | 1.50Å | Aromatic |
O20 | S18 | doub | 1.42Å | 1.44Å | |
N21 | C22 | sing | 1.50Å | 1.46Å | |
N21 | S18 | sing | 1.66Å | 1.52Å | |
C8 | N10 | sing | 1.35Å | 1.34Å | |
C3 | C2 | sing | 1.51Å | 1.51Å | |
C22 | C23 | sing | 1.46Å | 1.52Å | |
S18 | C13 | sing | 1.76Å | 1.61Å | |
S18 | O19 | doub | 1.42Å | 1.44Å | |
C12 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
C12 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
C2 | C1 | sing | 1.53Å | 1.53Å | |
N10 | C11 | sing | 1.40Å | 1.37Å | |
C13 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
C11 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
C1 | C6 | sing | 1.53Å | 1.52Å | |
C14 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
C15 | H1 | sing | 1.08Å | 1.08Å | |
C14 | H2 | sing | 1.08Å | 1.08Å | |
C12 | H3 | sing | 1.08Å | 1.08Å | |
C16 | H4 | sing | 1.08Å | 1.08Å | |
C26 | H5 | sing | 1.09Å | 1.10Å | |
C26 | H6 | sing | 1.09Å | 1.10Å | |
C26 | H7 | sing | 1.09Å | 1.10Å | |
C29 | H8 | sing | 1.09Å | 1.10Å | |
C29 | H9 | sing | 1.09Å | 1.10Å | |
C29 | H10 | sing | 1.09Å | 1.10Å | |
C1 | H11 | sing | 1.09Å | 1.10Å | |
C1 | H12 | sing | 1.09Å | 1.10Å | |
C23 | H13 | sing | 1.09Å | 1.10Å | |
C23 | H14 | sing | 1.09Å | 1.10Å | |
C25 | H15 | sing | 1.09Å | 1.10Å | |
C25 | H16 | sing | 1.09Å | 1.10Å | |
C2 | H17 | sing | 1.09Å | 1.10Å | |
C2 | H18 | sing | 1.09Å | 1.10Å | |
C22 | H19 | sing | 1.09Å | 1.10Å | |
C22 | H20 | sing | 1.09Å | 1.10Å | |
C24 | H21 | sing | 1.09Å | 1.10Å | |
C24 | H22 | sing | 1.09Å | 1.10Å | |
N6 | H23 | sing | 0.97Å | 1.00Å | |
N10 | H24 | sing | 0.97Å | 1.00Å | |
C6 | H25 | sing | 1.09Å | 1.10Å | |
C6 | H26 | sing | 1.09Å | 1.10Å | |
C6 | H27 | sing | 1.09Å | 1.10Å | |
C9 | H28 | sing | 1.09Å | 1.10Å | |
C9 | H29 | sing | 1.09Å | 1.10Å | |
C10 | H30 | sing | 1.09Å | 1.10Å | |
C10 | H31 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C26 | C5 | N6 | 123.8° | 125.9° |
C26 | C5 | C4 | 128.7° | 125.8° |
C5 | C26 | H5 | 109.5° | 109.4° |
C5 | C26 | H6 | 109.4° | 109.5° |
C5 | C26 | H7 | 109.5° | 109.4° |
C9 | C25 | C24 | 112.5° | 110.1° |
C25 | C9 | C10 | 111.6° | 110.9° |
C9 | C25 | H15 | 108.7° | 109.4° |
C9 | C25 | H16 | 108.7° | 109.4° |
C25 | C9 | H28 | 109.0° | 109.2° |
C25 | C9 | H29 | 108.9° | 109.2° |
C25 | C24 | N21 | 107.9° | 116.1° |
C24 | C25 | H15 | 108.7° | 109.5° |
C24 | C25 | H16 | 108.7° | 109.2° |
C25 | C24 | H21 | 109.9° | 108.2° |
C25 | C24 | H22 | 109.9° | 108.2° |
C9 | C10 | C23 | 113.0° | 105.4° |
C10 | C9 | H28 | 108.9° | 109.0° |
C10 | C9 | H29 | 108.9° | 109.3° |
C9 | C10 | H30 | 108.6° | 110.3° |
C9 | C10 | H31 | 108.6° | 110.2° |
C24 | N21 | C22 | 121.0° | 118.9° |
C24 | N21 | S18 | 118.6° | 120.6° |
N21 | C24 | H21 | 109.8° | 108.2° |
N21 | C24 | H22 | 109.8° | 108.0° |
N6 | C5 | C4 | 107.5° | 108.3° |
C5 | N6 | C7 | 111.1° | 109.3° |
C5 | N6 | H23 | 124.5° | 125.3° |
C5 | C4 | C27 | 124.5° | 126.5° |
C5 | C4 | C3 | 108.1° | 107.0° |
N6 | C7 | C8 | 125.8° | 125.8° |
N6 | C7 | C3 | 109.4° | 108.4° |
C7 | N6 | H23 | 124.4° | 125.4° |
O9 | C8 | C7 | 115.7° | 120.0° |
O9 | C8 | N10 | 122.6° | 120.0° |
O28 | C27 | C4 | 121.8° | 119.9° |
O28 | C27 | C29 | 120.1° | 120.0° |
C27 | C4 | C3 | 127.3° | 126.5° |
C4 | C27 | C29 | 118.0° | 120.0° |
C4 | C3 | C7 | 103.9° | 107.0° |
C4 | C3 | C2 | 128.5° | 126.5° |
C27 | C29 | H8 | 109.5° | 109.5° |
C27 | C29 | H9 | 109.5° | 109.5° |
C27 | C29 | H10 | 109.5° | 109.5° |
C10 | C23 | C22 | 113.7° | 114.1° |
C10 | C23 | H13 | 108.4° | 108.6° |
C10 | C23 | H14 | 108.4° | 108.5° |
C23 | C10 | H30 | 108.6° | 110.2° |
C23 | C10 | H31 | 108.6° | 110.2° |
C8 | C7 | C3 | 124.7° | 125.8° |
C7 | C8 | N10 | 121.7° | 120.0° |
C7 | C3 | C2 | 127.6° | 126.5° |
O20 | S18 | N21 | 106.5° | 106.4° |
O20 | S18 | C13 | 110.8° | 106.4° |
O20 | S18 | O19 | 108.5° | 123.2° |
C22 | N21 | S18 | 120.4° | 120.5° |
N21 | C22 | C23 | 106.5° | 107.6° |
N21 | C22 | H19 | 110.2° | 109.8° |
N21 | C22 | H20 | 110.2° | 109.9° |
N21 | S18 | C13 | 113.7° | 107.2° |
N21 | S18 | O19 | 109.5° | 106.4° |
C8 | N10 | C11 | 124.9° | 120.0° |
C8 | N10 | H24 | 117.5° | 120.0° |
C3 | C2 | C1 | 108.0° | 109.4° |
C3 | C2 | H17 | 109.8° | 109.5° |
C3 | C2 | H18 | 109.8° | 109.5° |
C22 | C23 | H13 | 108.4° | 108.5° |
C22 | C23 | H14 | 108.4° | 108.5° |
C23 | C22 | H19 | 110.2° | 109.9° |
C23 | C22 | H20 | 110.2° | 109.9° |
C13 | S18 | O19 | 107.7° | 106.4° |
S18 | C13 | C12 | 121.0° | 119.9° |
S18 | C13 | C14 | 119.1° | 120.0° |
C13 | C12 | C11 | 120.5° | 119.9° |
C12 | C13 | C14 | 119.8° | 120.1° |
C13 | C12 | H3 | 119.8° | 120.1° |
C12 | C11 | N10 | 125.0° | 120.1° |
C12 | C11 | C16 | 118.5° | 119.8° |
C11 | C12 | H3 | 119.7° | 120.0° |
C2 | C1 | C6 | 112.9° | 109.4° |
C2 | C1 | H11 | 108.6° | 109.5° |
C2 | C1 | H12 | 108.6° | 109.5° |
C1 | C2 | H17 | 109.9° | 109.5° |
C1 | C2 | H18 | 109.9° | 109.4° |
N10 | C11 | C16 | 116.5° | 120.1° |
C11 | N10 | H24 | 117.5° | 120.0° |
C13 | C14 | C15 | 120.4° | 120.1° |
C13 | C14 | H2 | 119.8° | 119.9° |
C11 | C16 | C15 | 121.1° | 120.0° |
C11 | C16 | H4 | 119.4° | 120.0° |
C6 | C1 | H11 | 108.6° | 109.5° |
C6 | C1 | H12 | 108.6° | 109.5° |
C1 | C6 | H25 | 109.5° | 109.5° |
C1 | C6 | H26 | 109.4° | 109.5° |
C1 | C6 | H27 | 109.5° | 109.5° |
C14 | C15 | C16 | 119.8° | 120.1° |
C14 | C15 | H1 | 120.1° | 119.9° |
C15 | C14 | H2 | 119.8° | 120.0° |
C16 | C15 | H1 | 120.1° | 120.0° |
C15 | C16 | H4 | 119.5° | 120.0° |
H5 | C26 | H6 | 109.5° | 109.5° |
H5 | C26 | H7 | 109.5° | 109.5° |
H6 | C26 | H7 | 109.5° | 109.5° |
H8 | C29 | H9 | 109.5° | 109.4° |
H8 | C29 | H10 | 109.4° | 109.5° |
H9 | C29 | H10 | 109.5° | 109.4° |
H11 | C1 | H12 | 109.5° | 109.5° |
H13 | C23 | H14 | 109.5° | 108.5° |
H15 | C25 | H16 | 109.5° | 109.3° |
H17 | C2 | H18 | 109.5° | 109.5° |
H19 | C22 | H20 | 109.4° | 109.9° |
H21 | C24 | H22 | 109.5° | 107.8° |
H25 | C6 | H26 | 109.5° | 109.5° |
H25 | C6 | H27 | 109.4° | 109.4° |
H26 | C6 | H27 | 109.4° | 109.5° |
H28 | C9 | H29 | 109.5° | 109.2° |
H30 | C10 | H31 | 109.4° | 110.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C26 | C5 | N6 | C4 | 180.0° | 179.5° |
C26 | C5 | N6 | C7 | 179.9° | 179.9° |
C26 | C5 | C4 | C27 | 0.9° | 0.3° |
C26 | C5 | C4 | C3 | 179.4° | 179.9° |
C5 | C26 | H5 | H6 | 120.0° | 120.0° |
C5 | C26 | H5 | H7 | 120.0° | 119.9° |
C5 | C26 | H6 | H7 | 120.0° | 120.0° |
C26 | C5 | N6 | H23 | 0.1° | 0.5° |
C9 | C25 | C24 | H15 | 120.4° | 120.3° |
C9 | C25 | C24 | H16 | 120.5° | 120.1° |
C25 | C9 | C10 | H28 | 120.3° | 120.3° |
C25 | C9 | C10 | H29 | 120.3° | 120.4° |
C9 | C25 | C24 | N21 | 72.4° | 41.5° |
C25 | C9 | C10 | C23 | 44.4° | 97.7° |
C9 | C25 | H15 | H16 | 118.6° | 119.7° |
C9 | C25 | C24 | H21 | 47.3° | 80.3° |
C9 | C25 | C24 | H22 | 167.8° | 163.1° |
C25 | C9 | H28 | H29 | 119.0° | 119.3° |
C25 | C9 | C10 | H30 | 76.2° | 21.3° |
C25 | C9 | C10 | H31 | 164.9° | 143.3° |
C24 | C25 | C9 | C10 | 95.2° | 38.7° |
C25 | C24 | N21 | H21 | 119.7° | 121.8° |
C25 | C24 | N21 | H22 | 119.7° | 121.6° |
C25 | C24 | N21 | C22 | 59.1° | 91.6° |
C25 | C24 | N21 | S18 | 124.0° | 88.4° |
C24 | C25 | H15 | H16 | 118.6° | 119.6° |
C25 | C24 | H21 | H22 | 120.7° | 116.8° |
C24 | C25 | C9 | H28 | 144.4° | 81.4° |
C24 | C25 | C9 | H29 | 25.1° | 159.2° |
C9 | C10 | C23 | H30 | 120.6° | 119.0° |
C9 | C10 | C23 | H31 | 120.6° | 118.9° |
C9 | C10 | C23 | C22 | 37.8° | 89.5° |
C9 | C10 | C23 | H13 | 82.8° | 149.4° |
C9 | C10 | C23 | H14 | 158.5° | 31.6° |
C10 | C9 | C25 | H15 | 144.3° | 159.1° |
C10 | C9 | C25 | H16 | 25.2° | 81.3° |
C10 | C9 | H28 | H29 | 119.0° | 119.4° |
C9 | C10 | H30 | H31 | 118.4° | 122.0° |
C24 | N21 | S18 | O20 | 31.3° | 156.5° |
C24 | N21 | C22 | S18 | 176.8° | 179.9° |
C24 | N21 | C22 | C23 | 80.9° | 70.4° |
C24 | N21 | S18 | C13 | 91.0° | 89.9° |
C24 | N21 | S18 | O19 | 148.5° | 23.6° |
N21 | C24 | C25 | H15 | 167.1° | 78.8° |
N21 | C24 | C25 | H16 | 48.0° | 161.6° |
C24 | N21 | C22 | H19 | 38.6° | 170.1° |
C24 | N21 | C22 | H20 | 159.5° | 49.2° |
N21 | C24 | H21 | H22 | 120.7° | 116.6° |
C5 | N6 | C7 | H23 | 180.0° | 179.5° |
N6 | C5 | C4 | C27 | 179.1° | 179.8° |
N6 | C5 | C4 | C3 | 0.6° | 0.4° |
C5 | N6 | C7 | C8 | 179.1° | 179.7° |
C5 | N6 | C7 | C3 | 0.7° | 0.3° |
N6 | C5 | C26 | H5 | 90.0° | 95.3° |
N6 | C5 | C26 | H6 | 150.0° | 144.7° |
N6 | C5 | C26 | H7 | 30.0° | 24.6° |
C4 | C5 | N6 | C7 | 0.1° | 0.4° |
C5 | C4 | C27 | O28 | 27.7° | 85.3° |
C5 | C4 | C27 | C3 | 178.2° | 179.7° |
C5 | C4 | C27 | C29 | 150.3° | 94.7° |
C5 | C4 | C3 | C7 | 0.9° | 0.3° |
C5 | C4 | C3 | C2 | 179.6° | 179.8° |
C4 | C5 | C26 | H5 | 90.0° | 85.2° |
C4 | C5 | C26 | H6 | 30.0° | 34.8° |
C4 | C5 | C26 | H7 | 150.0° | 154.8° |
C4 | C5 | N6 | H23 | 179.9° | 180.0° |
N6 | C7 | C8 | O9 | 27.5° | 180.0° |
N6 | C7 | C3 | C4 | 1.0° | 0.0° |
N6 | C7 | C8 | C3 | 178.2° | 179.9° |
N6 | C7 | C8 | N10 | 153.7° | 0.1° |
N6 | C7 | C3 | C2 | 179.7° | 179.9° |
O9 | C8 | C7 | N10 | 178.8° | 180.0° |
O9 | C8 | C7 | C3 | 150.6° | 0.0° |
O9 | C8 | N10 | C11 | 3.8° | 4.6° |
O9 | C8 | N10 | H24 | 176.2° | 175.5° |
O28 | C27 | C4 | C29 | 177.9° | 180.0° |
O28 | C27 | C4 | C3 | 154.1° | 94.4° |
O28 | C27 | C29 | H8 | 0.0° | 95.0° |
O28 | C27 | C29 | H9 | 120.0° | 25.0° |
O28 | C27 | C29 | H10 | 120.0° | 144.9° |
C27 | C4 | C3 | C7 | 179.4° | 179.9° |
C27 | C4 | C3 | C2 | 2.0° | 0.0° |
C4 | C27 | C29 | H8 | 178.0° | 85.0° |
C4 | C27 | C29 | H9 | 58.0° | 155.0° |
C4 | C27 | C29 | H10 | 62.0° | 35.1° |
C3 | C4 | C27 | C29 | 28.0° | 85.6° |
C4 | C3 | C7 | C8 | 179.4° | 180.0° |
C4 | C3 | C7 | C2 | 178.6° | 179.9° |
C4 | C3 | C2 | C1 | 80.5° | 90.0° |
C4 | C3 | C2 | H17 | 39.3° | 150.0° |
C4 | C3 | C2 | H18 | 159.8° | 30.0° |
C27 | C29 | H8 | H9 | 120.0° | 120.0° |
C27 | C29 | H8 | H10 | 120.0° | 120.1° |
C27 | C29 | H9 | H10 | 120.0° | 120.0° |
C10 | C23 | C22 | N21 | 90.8° | 58.5° |
C10 | C23 | C22 | H13 | 120.6° | 121.2° |
C10 | C23 | C22 | H14 | 120.6° | 121.1° |
C10 | C23 | H13 | H14 | 118.1° | 117.7° |
C10 | C23 | C22 | H19 | 28.7° | 177.9° |
C10 | C23 | C22 | H20 | 149.7° | 61.1° |
C23 | C10 | C9 | H28 | 164.7° | 22.5° |
C23 | C10 | C9 | H29 | 75.9° | 141.8° |
C23 | C10 | H30 | H31 | 118.3° | 122.0° |
C8 | C7 | C3 | C2 | 1.9° | 0.1° |
C7 | C8 | N10 | C11 | 174.9° | 175.5° |
C8 | C7 | N6 | H23 | 0.9° | 0.1° |
C7 | C8 | N10 | H24 | 5.1° | 4.4° |
C3 | C7 | C8 | N10 | 28.1° | 180.0° |
C7 | C3 | C2 | C1 | 97.8° | 90.1° |
C7 | C3 | C2 | H17 | 142.4° | 29.9° |
C7 | C3 | C2 | H18 | 21.9° | 150.0° |
C3 | C7 | N6 | H23 | 179.3° | 179.8° |
O20 | S18 | N21 | C22 | 145.6° | 23.6° |
O20 | S18 | N21 | C13 | 122.3° | 113.6° |
O20 | S18 | N21 | O19 | 117.2° | 132.9° |
O20 | S18 | C13 | O19 | 118.6° | 132.9° |
O20 | S18 | C13 | C12 | 21.5° | 23.6° |
O20 | S18 | C13 | C14 | 157.3° | 156.8° |
N21 | C22 | C23 | H19 | 119.6° | 119.5° |
N21 | C22 | C23 | H20 | 119.5° | 119.6° |
C22 | N21 | S18 | C13 | 92.1° | 90.0° |
C22 | N21 | S18 | O19 | 28.4° | 156.5° |
N21 | C22 | C23 | H13 | 29.8° | 179.6° |
N21 | C22 | C23 | H14 | 148.6° | 62.7° |
N21 | C22 | H19 | H20 | 121.4° | 120.9° |
C22 | N21 | C24 | H21 | 60.6° | 30.3° |
C22 | N21 | C24 | H22 | 178.9° | 146.8° |
S18 | N21 | C22 | C23 | 102.3° | 109.6° |
N21 | S18 | C13 | O19 | 121.5° | 113.5° |
N21 | S18 | C13 | C12 | 98.4° | 90.0° |
N21 | S18 | C13 | C14 | 82.9° | 89.7° |
S18 | N21 | C22 | H19 | 138.2° | 9.9° |
S18 | N21 | C22 | H20 | 17.3° | 130.9° |
S18 | N21 | C24 | H21 | 116.2° | 149.8° |
S18 | N21 | C24 | H22 | 4.3° | 33.2° |
C8 | N10 | C11 | C12 | 3.4° | 144.3° |
C8 | N10 | C11 | H24 | 180.0° | 179.9° |
C8 | N10 | C11 | C16 | 176.4° | 36.1° |
C3 | C2 | C1 | H17 | 119.7° | 120.0° |
C3 | C2 | C1 | H18 | 119.8° | 120.0° |
C3 | C2 | C1 | C6 | 149.1° | 180.0° |
C3 | C2 | C1 | H11 | 90.4° | 60.0° |
C3 | C2 | C1 | H12 | 28.6° | 60.0° |
C3 | C2 | H17 | H18 | 120.7° | 120.0° |
C22 | C23 | H13 | H14 | 118.0° | 117.7° |
C23 | C22 | H19 | H20 | 121.4° | 121.0° |
C22 | C23 | C10 | H30 | 158.4° | 29.5° |
C22 | C23 | C10 | H31 | 82.7° | 151.6° |
S18 | C13 | C12 | C14 | 178.7° | 179.7° |
S18 | C13 | C12 | C11 | 179.3° | 180.0° |
S18 | C13 | C14 | C15 | 179.3° | 179.7° |
S18 | C13 | C14 | H2 | 0.6° | 0.3° |
S18 | C13 | C12 | H3 | 0.7° | 0.4° |
O19 | S18 | C13 | C12 | 140.1° | 156.5° |
O19 | S18 | C13 | C14 | 38.7° | 23.8° |
C13 | C12 | C11 | H3 | 180.0° | 179.7° |
C13 | C12 | C11 | N10 | 179.5° | 180.0° |
C13 | C12 | C11 | C16 | 0.4° | 0.3° |
C12 | C13 | C14 | C15 | 0.6° | 0.0° |
C12 | C13 | C14 | H2 | 179.4° | 180.0° |
C12 | C11 | N10 | C16 | 179.8° | 179.7° |
C11 | C12 | C13 | C14 | 0.6° | 0.3° |
C12 | C11 | C16 | C15 | 0.1° | 0.1° |
C12 | C11 | C16 | H4 | 179.9° | 180.0° |
C12 | C11 | N10 | H24 | 176.6° | 35.6° |
C2 | C1 | C6 | H11 | 120.5° | 120.0° |
C2 | C1 | C6 | H12 | 120.5° | 120.0° |
C2 | C1 | H11 | H12 | 118.5° | 120.0° |
C1 | C2 | H17 | H18 | 120.7° | 120.0° |
C2 | C1 | C6 | H25 | 180.0° | 60.0° |
C2 | C1 | C6 | H26 | 60.0° | 60.0° |
C2 | C1 | C6 | H27 | 60.0° | 180.0° |
N10 | C11 | C16 | C15 | 179.8° | 179.7° |
N10 | C11 | C12 | H3 | 0.6° | 0.4° |
N10 | C11 | C16 | H4 | 0.2° | 0.3° |
C13 | C14 | C15 | H2 | 180.0° | 180.0° |
C13 | C14 | C15 | C16 | 0.3° | 0.2° |
C13 | C14 | C15 | H1 | 179.7° | 180.0° |
C14 | C13 | C12 | H3 | 179.4° | 180.0° |
C11 | C16 | C15 | C14 | 0.0° | 0.2° |
C11 | C16 | C15 | H4 | 180.0° | 179.9° |
C11 | C16 | C15 | H1 | 180.0° | 180.0° |
C16 | C11 | C12 | H3 | 179.6° | 180.0° |
C16 | C11 | N10 | H24 | 3.6° | 144.0° |
C6 | C1 | H11 | H12 | 118.4° | 120.0° |
C6 | C1 | C2 | H17 | 29.3° | 60.0° |
C6 | C1 | C2 | H18 | 91.1° | 60.0° |
C1 | C6 | H25 | H26 | 120.0° | 120.0° |
C1 | C6 | H25 | H27 | 120.0° | 120.0° |
C1 | C6 | H26 | H27 | 120.0° | 120.0° |
C14 | C15 | C16 | H1 | 180.0° | 179.7° |
C14 | C15 | C16 | H4 | 180.0° | 179.7° |
C16 | C15 | C14 | H2 | 179.7° | 179.8° |
H1 | C15 | C14 | H2 | 0.3° | 0.0° |
H1 | C15 | C16 | H4 | 0.0° | 0.0° |
H5 | C26 | H6 | H7 | 120.0° | 120.1° |
H8 | C29 | H9 | H10 | 119.9° | 120.0° |
H11 | C1 | C2 | H17 | 149.8° | 180.0° |
H11 | C1 | C2 | H18 | 29.3° | 60.0° |
H11 | C1 | C6 | H25 | 59.5° | 180.0° |
H11 | C1 | C6 | H26 | 179.5° | 60.0° |
H11 | C1 | C6 | H27 | 60.5° | 60.1° |
H12 | C1 | C2 | H17 | 91.2° | 60.0° |
H12 | C1 | C2 | H18 | 148.3° | 180.0° |
H12 | C1 | C6 | H25 | 59.5° | 60.0° |
H12 | C1 | C6 | H26 | 60.6° | 180.0° |
H12 | C1 | C6 | H27 | 179.5° | 60.0° |
H13 | C23 | C22 | H19 | 149.4° | 60.9° |
H13 | C23 | C22 | H20 | 89.7° | 60.1° |
H13 | C23 | C10 | H30 | 37.8° | 91.6° |
H13 | C23 | C10 | H31 | 156.7° | 30.5° |
H14 | C23 | C22 | H19 | 91.9° | 56.8° |
H14 | C23 | C22 | H20 | 29.0° | 177.8° |
H14 | C23 | C10 | H30 | 81.0° | 150.7° |
H14 | C23 | C10 | H31 | 37.9° | 87.3° |
H15 | C25 | C24 | H21 | 73.2° | 159.4° |
H15 | C25 | C24 | H22 | 47.4° | 42.8° |
H15 | C25 | C9 | H28 | 24.0° | 38.9° |
H15 | C25 | C9 | H29 | 95.4° | 80.4° |
H16 | C25 | C24 | H21 | 167.7° | 39.8° |
H16 | C25 | C24 | H22 | 71.7° | 76.8° |
H16 | C25 | C9 | H28 | 95.1° | 158.5° |
H16 | C25 | C9 | H29 | 145.5° | 39.2° |
H25 | C6 | H26 | H27 | 120.0° | 120.0° |
H28 | C9 | C10 | H30 | 44.1° | 141.5° |
H28 | C9 | C10 | H31 | 74.8° | 96.4° |
H29 | C9 | C10 | H30 | 163.5° | 99.2° |
H29 | C9 | C10 | H31 | 44.6° | 22.9° |