E8P
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C59 | C61 | doub | 1.38Å | 1.38Å | Aromatic |
C59 | C57 | sing | 1.38Å | 1.39Å | Aromatic |
C61 | C63 | sing | 1.38Å | 1.38Å | Aromatic |
C57 | C56 | doub | 1.38Å | 1.39Å | Aromatic |
C63 | C65 | doub | 1.38Å | 1.39Å | Aromatic |
O53 | C52 | doub | 1.21Å | 1.21Å | |
C56 | C65 | sing | 1.38Å | 1.39Å | Aromatic |
C56 | C50 | sing | 1.51Å | 1.54Å | |
C52 | C50 | sing | 1.51Å | 1.53Å | |
C52 | O55 | sing | 1.34Å | 1.31Å | |
C50 | N48 | sing | 1.46Å | 1.46Å | |
N48 | C46 | sing | 1.35Å | 1.34Å | |
O47 | C46 | doub | 1.21Å | 1.23Å | |
C46 | C44 | sing | 1.51Å | 1.54Å | |
C44 | C39 | sing | 1.56Å | 1.54Å | |
C44 | N30 | sing | 1.48Å | 1.47Å | |
O29 | C28 | doub | 1.21Å | 1.22Å | |
C39 | C41 | sing | 1.57Å | 1.53Å | |
C39 | C36 | sing | 1.56Å | 1.54Å | |
N30 | C28 | sing | 1.35Å | 1.36Å | |
N30 | C31 | sing | 1.49Å | 1.48Å | |
C28 | C17 | sing | 1.51Å | 1.52Å | |
C41 | C31 | sing | 1.57Å | 1.53Å | |
C14 | C11 | sing | 1.53Å | 1.53Å | |
C14 | C17 | sing | 1.53Å | 1.56Å | |
C11 | C08 | sing | 1.53Å | 1.53Å | |
C05 | C08 | sing | 1.53Å | 1.52Å | |
C05 | C01 | sing | 1.53Å | 1.51Å | |
C31 | C33 | sing | 1.56Å | 1.52Å | |
C17 | C19 | sing | 1.53Å | 1.54Å | |
C36 | C33 | sing | 1.55Å | 1.54Å | |
C19 | C22 | sing | 1.51Å | 1.52Å | |
C22 | N24 | sing | 1.35Å | 1.32Å | |
C22 | O23 | doub | 1.21Å | 1.22Å | |
N24 | O26 | sing | 1.42Å | 1.39Å | |
C17 | H1 | sing | 1.09Å | 1.10Å | |
C01 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C01 | H4 | sing | 1.09Å | 1.10Å | |
C05 | H5 | sing | 1.09Å | 1.10Å | |
C05 | H6 | sing | 1.09Å | 1.10Å | |
C08 | H7 | sing | 1.09Å | 1.10Å | |
C08 | H8 | sing | 1.09Å | 1.10Å | |
C11 | H9 | sing | 1.09Å | 1.10Å | |
C11 | H10 | sing | 1.09Å | 1.10Å | |
C14 | H11 | sing | 1.09Å | 1.10Å | |
C14 | H12 | sing | 1.09Å | 1.10Å | |
C19 | H13 | sing | 1.09Å | 1.10Å | |
C19 | H14 | sing | 1.09Å | 1.10Å | |
N24 | H15 | sing | 0.97Å | 1.00Å | |
O26 | H16 | sing | 0.97Å | 0.95Å | |
C31 | H17 | sing | 1.09Å | 1.10Å | |
C33 | H18 | sing | 1.09Å | 1.10Å | |
C33 | H19 | sing | 1.09Å | 1.10Å | |
C36 | H20 | sing | 1.09Å | 1.10Å | |
C36 | H21 | sing | 1.09Å | 1.10Å | |
C39 | H22 | sing | 1.09Å | 1.10Å | |
C41 | H23 | sing | 1.09Å | 1.10Å | |
C41 | H24 | sing | 1.09Å | 1.10Å | |
C44 | H25 | sing | 1.09Å | 1.10Å | |
N48 | H26 | sing | 0.97Å | 1.00Å | |
C50 | H27 | sing | 1.09Å | 1.10Å | |
O55 | H28 | sing | 0.97Å | 0.95Å | |
C57 | H29 | sing | 1.08Å | 1.08Å | |
C59 | H30 | sing | 1.08Å | 1.08Å | |
C61 | H31 | sing | 1.08Å | 1.08Å | |
C63 | H32 | sing | 1.08Å | 1.08Å | |
C65 | H33 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C61 | C59 | C57 | 120.3° | 120.0° |
C59 | C61 | C63 | 119.6° | 120.0° |
C61 | C59 | H30 | 119.9° | 120.0° |
C59 | C61 | H31 | 120.2° | 120.0° |
C59 | C57 | C56 | 120.8° | 120.0° |
C59 | C57 | H29 | 119.6° | 120.0° |
C57 | C59 | H30 | 119.8° | 120.0° |
C61 | C63 | C65 | 120.3° | 120.0° |
C63 | C61 | H31 | 120.2° | 120.0° |
C61 | C63 | H32 | 119.8° | 119.9° |
C57 | C56 | C65 | 118.3° | 120.0° |
C57 | C56 | C50 | 120.0° | 120.0° |
C56 | C57 | H29 | 119.6° | 120.0° |
C63 | C65 | C56 | 120.7° | 120.0° |
C65 | C63 | H32 | 119.9° | 120.0° |
C63 | C65 | H33 | 119.6° | 120.0° |
O53 | C52 | C50 | 122.2° | 120.0° |
O53 | C52 | O55 | 123.9° | 120.0° |
C65 | C56 | C50 | 121.7° | 119.9° |
C56 | C65 | H33 | 119.7° | 120.0° |
C56 | C50 | C52 | 109.3° | 109.5° |
C56 | C50 | N48 | 114.6° | 109.5° |
C56 | C50 | H27 | 107.3° | 109.5° |
C50 | C52 | O55 | 113.9° | 120.0° |
C52 | C50 | N48 | 109.7° | 109.5° |
C52 | C50 | H27 | 107.4° | 109.4° |
C52 | O55 | H28 | 109.5° | 117.0° |
C50 | N48 | C46 | 125.3° | 120.0° |
C50 | N48 | H26 | 117.3° | 120.0° |
N48 | C50 | H27 | 108.2° | 109.5° |
N48 | C46 | O47 | 123.9° | 120.0° |
N48 | C46 | C44 | 113.8° | 120.0° |
C46 | N48 | H26 | 117.4° | 120.0° |
O47 | C46 | C44 | 122.2° | 120.0° |
C46 | C44 | C39 | 108.8° | 110.3° |
C46 | C44 | N30 | 113.2° | 110.6° |
C46 | C44 | H25 | 110.8° | 110.4° |
C39 | C44 | N30 | 100.9° | 105.2° |
C44 | C39 | C41 | 100.9° | 99.3° |
C44 | C39 | C36 | 109.0° | 104.2° |
C44 | C39 | H22 | 114.6° | 117.0° |
C39 | C44 | H25 | 110.8° | 110.3° |
C44 | N30 | C28 | 122.7° | 126.6° |
C44 | N30 | C31 | 107.3° | 106.7° |
N30 | C44 | H25 | 111.9° | 110.0° |
O29 | C28 | N30 | 120.8° | 120.0° |
O29 | C28 | C17 | 120.0° | 120.0° |
C41 | C39 | C36 | 101.7° | 100.5° |
C39 | C41 | C31 | 92.6° | 95.2° |
C41 | C39 | H22 | 114.7° | 116.8° |
C39 | C41 | H23 | 113.5° | 112.2° |
C39 | C41 | H24 | 113.5° | 112.2° |
C39 | C36 | C33 | 103.2° | 104.1° |
C39 | C36 | H20 | 111.0° | 110.5° |
C39 | C36 | H21 | 111.0° | 110.6° |
C36 | C39 | H22 | 114.6° | 116.3° |
C28 | N30 | C31 | 129.5° | 126.7° |
N30 | C28 | C17 | 119.1° | 120.0° |
N30 | C31 | C41 | 102.8° | 101.2° |
N30 | C31 | C33 | 107.6° | 104.6° |
N30 | C31 | H17 | 115.2° | 115.7° |
C28 | C17 | C14 | 108.5° | 109.4° |
C28 | C17 | C19 | 109.4° | 109.5° |
C28 | C17 | H1 | 108.6° | 109.5° |
C41 | C31 | C33 | 100.7° | 100.8° |
C41 | C31 | H17 | 114.4° | 116.7° |
C31 | C41 | H23 | 113.5° | 112.2° |
C31 | C41 | H24 | 113.5° | 112.2° |
C11 | C14 | C17 | 120.9° | 109.5° |
C14 | C11 | C08 | 114.5° | 109.5° |
C14 | C11 | H9 | 108.2° | 109.5° |
C14 | C11 | H10 | 108.2° | 109.5° |
C11 | C14 | H11 | 106.5° | 109.5° |
C11 | C14 | H12 | 106.5° | 109.4° |
C14 | C17 | C19 | 113.7° | 109.4° |
C14 | C17 | H1 | 108.1° | 109.5° |
C17 | C14 | H11 | 106.5° | 109.5° |
C17 | C14 | H12 | 106.6° | 109.5° |
C11 | C08 | C05 | 113.5° | 109.5° |
C11 | C08 | H7 | 108.5° | 109.5° |
C11 | C08 | H8 | 108.5° | 109.5° |
C08 | C11 | H9 | 108.2° | 109.5° |
C08 | C11 | H10 | 108.2° | 109.5° |
C08 | C05 | C01 | 113.3° | 109.5° |
C08 | C05 | H5 | 108.5° | 109.5° |
C08 | C05 | H6 | 108.5° | 109.4° |
C05 | C08 | H7 | 108.4° | 109.5° |
C05 | C08 | H8 | 108.4° | 109.4° |
C05 | C01 | H2 | 109.5° | 109.5° |
C05 | C01 | H3 | 109.4° | 109.4° |
C05 | C01 | H4 | 109.4° | 109.5° |
C01 | C05 | H5 | 108.5° | 109.5° |
C01 | C05 | H6 | 108.5° | 109.5° |
C31 | C33 | C36 | 102.2° | 104.5° |
C33 | C31 | H17 | 114.5° | 115.7° |
C31 | C33 | H18 | 111.3° | 110.4° |
C31 | C33 | H19 | 111.3° | 110.4° |
C17 | C19 | C22 | 112.2° | 109.5° |
C19 | C17 | H1 | 108.4° | 109.5° |
C17 | C19 | H13 | 108.8° | 109.5° |
C17 | C19 | H14 | 108.8° | 109.4° |
C36 | C33 | H18 | 111.3° | 110.5° |
C36 | C33 | H19 | 111.3° | 110.5° |
C33 | C36 | H20 | 111.0° | 110.5° |
C33 | C36 | H21 | 111.0° | 110.5° |
C19 | C22 | N24 | 113.7° | 120.0° |
C19 | C22 | O23 | 122.6° | 120.0° |
C22 | C19 | H13 | 108.8° | 109.4° |
C22 | C19 | H14 | 108.8° | 109.5° |
N24 | C22 | O23 | 123.7° | 120.0° |
C22 | N24 | O26 | 118.4° | 120.0° |
C22 | N24 | H15 | 120.8° | 120.0° |
O26 | N24 | H15 | 120.8° | 120.0° |
N24 | O26 | H16 | 109.5° | 114.0° |
H2 | C01 | H3 | 109.5° | 109.5° |
H2 | C01 | H4 | 109.5° | 109.4° |
H3 | C01 | H4 | 109.5° | 109.5° |
H5 | C05 | H6 | 109.5° | 109.5° |
H7 | C08 | H8 | 109.5° | 109.5° |
H9 | C11 | H10 | 109.5° | 109.5° |
H11 | C14 | H12 | 109.5° | 109.4° |
H13 | C19 | H14 | 109.5° | 109.5° |
H18 | C33 | H19 | 109.4° | 110.5° |
H20 | C36 | H21 | 109.4° | 110.5° |
H23 | C41 | H24 | 109.5° | 111.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C61 | C59 | C57 | H30 | 180.0° | 179.9° |
C59 | C61 | C63 | H31 | 180.0° | 180.0° |
C61 | C59 | C57 | C56 | 0.6° | 0.1° |
C59 | C61 | C63 | C65 | 0.1° | 0.1° |
C61 | C59 | C57 | H29 | 179.4° | 180.0° |
C59 | C61 | C63 | H32 | 179.8° | 180.0° |
C57 | C59 | C61 | C63 | 0.2° | 0.0° |
C59 | C57 | C56 | H29 | 180.0° | 179.8° |
C59 | C57 | C56 | C65 | 0.8° | 0.1° |
C59 | C57 | C56 | C50 | 179.2° | 179.8° |
C57 | C59 | C61 | H31 | 179.8° | 180.0° |
C61 | C63 | C65 | H32 | 180.0° | 179.9° |
C61 | C63 | C65 | C56 | 0.4° | 0.1° |
C63 | C61 | C59 | H30 | 179.8° | 179.9° |
C61 | C63 | C65 | H33 | 179.6° | 179.8° |
C57 | C56 | C65 | C63 | 0.7° | 0.0° |
C57 | C56 | C65 | C50 | 178.4° | 179.7° |
C57 | C56 | C50 | C52 | 65.4° | 79.7° |
C57 | C56 | C50 | N48 | 171.0° | 40.3° |
C57 | C56 | C50 | H27 | 50.8° | 160.3° |
C56 | C57 | C59 | H30 | 179.4° | 179.9° |
C57 | C56 | C65 | H33 | 179.3° | 179.7° |
C63 | C65 | C56 | H33 | 180.0° | 179.7° |
C63 | C65 | C56 | C50 | 179.1° | 179.7° |
C65 | C63 | C61 | H31 | 179.9° | 179.9° |
O53 | C52 | C50 | C56 | 90.2° | 120.0° |
O53 | C52 | C50 | O55 | 179.5° | 179.9° |
O53 | C52 | C50 | N48 | 143.3° | 0.0° |
O53 | C52 | C50 | H27 | 25.9° | 120.0° |
O53 | C52 | O55 | H28 | 0.0° | 0.1° |
C65 | C56 | C50 | C52 | 113.0° | 100.0° |
C65 | C56 | C50 | N48 | 10.6° | 140.0° |
C65 | C56 | C50 | H27 | 130.8° | 20.0° |
C65 | C56 | C57 | H29 | 179.2° | 179.9° |
C56 | C65 | C63 | H32 | 179.6° | 180.0° |
C56 | C50 | C52 | N48 | 126.5° | 120.0° |
C56 | C50 | C52 | H27 | 116.1° | 120.0° |
C56 | C50 | C52 | O55 | 90.2° | 60.0° |
C56 | C50 | N48 | H27 | 119.6° | 120.1° |
C56 | C50 | N48 | C46 | 81.4° | 158.6° |
C56 | C50 | N48 | H26 | 98.6° | 21.4° |
C50 | C56 | C57 | H29 | 0.7° | 0.3° |
C50 | C56 | C65 | H33 | 0.9° | 0.0° |
C52 | C50 | N48 | H27 | 116.9° | 120.0° |
C52 | C50 | N48 | C46 | 155.2° | 81.4° |
C52 | C50 | N48 | H26 | 24.8° | 98.6° |
C50 | C52 | O55 | H28 | 179.5° | 180.0° |
O55 | C52 | C50 | N48 | 36.3° | 180.0° |
O55 | C52 | C50 | H27 | 153.7° | 60.0° |
C50 | N48 | C46 | H26 | 180.0° | 180.0° |
C50 | N48 | C46 | O47 | 1.0° | 5.0° |
C50 | N48 | C46 | C44 | 176.2° | 175.0° |
N48 | C46 | O47 | C44 | 177.0° | 180.0° |
N48 | C46 | C44 | C39 | 67.9° | 76.7° |
N48 | C46 | C44 | N30 | 179.2° | 167.3° |
N48 | C46 | C44 | H25 | 54.2° | 45.4° |
C46 | N48 | C50 | H27 | 38.3° | 38.6° |
O47 | C46 | C44 | C39 | 109.4° | 103.3° |
O47 | C46 | C44 | N30 | 2.0° | 12.6° |
O47 | C46 | C44 | H25 | 128.6° | 134.6° |
O47 | C46 | N48 | H26 | 179.0° | 175.0° |
C46 | C44 | C39 | N30 | 119.3° | 119.3° |
C46 | C44 | C39 | H25 | 122.0° | 122.1° |
C46 | C44 | N30 | H25 | 126.1° | 122.2° |
C46 | C44 | C39 | C41 | 77.8° | 86.1° |
C46 | C44 | C39 | C36 | 175.7° | 170.4° |
C46 | C44 | N30 | C28 | 79.2° | 60.1° |
C46 | C44 | N30 | C31 | 108.1° | 119.6° |
C46 | C44 | C39 | H22 | 45.9° | 40.5° |
C44 | C46 | N48 | H26 | 3.8° | 5.1° |
C39 | C44 | N30 | H25 | 117.8° | 118.8° |
C44 | C39 | C41 | C36 | 112.2° | 106.4° |
C44 | C39 | C41 | H22 | 123.6° | 126.8° |
C44 | C39 | C36 | H22 | 129.8° | 130.4° |
C39 | C44 | N30 | C28 | 164.7° | 179.2° |
C39 | C44 | N30 | C31 | 7.9° | 0.5° |
C44 | C39 | C41 | C31 | 56.4° | 51.5° |
C44 | C39 | C36 | C33 | 73.8° | 67.2° |
C44 | C39 | C36 | H20 | 167.2° | 51.4° |
C44 | C39 | C36 | H21 | 45.2° | 174.1° |
C44 | C39 | C41 | H23 | 60.6° | 168.0° |
C44 | C39 | C41 | H24 | 173.5° | 65.1° |
C44 | N30 | C28 | O29 | 5.7° | 4.7° |
N30 | C44 | C39 | C41 | 41.5° | 33.2° |
N30 | C44 | C39 | C36 | 65.0° | 70.3° |
C44 | N30 | C28 | C31 | 170.9° | 179.6° |
C44 | N30 | C28 | C17 | 175.9° | 175.3° |
C44 | N30 | C31 | C41 | 28.5° | 34.2° |
C44 | N30 | C31 | C33 | 77.3° | 70.1° |
C44 | N30 | C31 | H17 | 153.6° | 161.3° |
N30 | C44 | C39 | H22 | 165.2° | 159.8° |
O29 | C28 | N30 | C17 | 178.4° | 180.0° |
O29 | C28 | N30 | C31 | 176.6° | 174.9° |
O29 | C28 | C17 | C14 | 78.1° | 6.9° |
O29 | C28 | C17 | C19 | 46.5° | 113.0° |
O29 | C28 | C17 | H1 | 164.6° | 126.9° |
C41 | C39 | C36 | H22 | 124.3° | 127.1° |
C39 | C41 | C31 | N30 | 51.5° | 53.0° |
C39 | C41 | C31 | H23 | 117.1° | 116.5° |
C39 | C41 | C31 | H24 | 117.1° | 116.5° |
C39 | C41 | C31 | C33 | 59.6° | 54.4° |
C41 | C39 | C36 | C33 | 32.2° | 35.3° |
C39 | C41 | C31 | H17 | 177.1° | 179.5° |
C41 | C39 | C36 | H20 | 86.8° | 154.0° |
C41 | C39 | C36 | H21 | 151.2° | 83.4° |
C39 | C41 | H23 | H24 | 128.0° | 127.1° |
C41 | C39 | C44 | H25 | 160.1° | 151.7° |
C36 | C39 | C41 | C31 | 55.7° | 55.0° |
C39 | C36 | C33 | C31 | 5.4° | 0.9° |
C39 | C36 | C33 | H20 | 119.0° | 118.6° |
C39 | C36 | C33 | H21 | 119.0° | 118.8° |
C39 | C36 | C33 | H18 | 124.2° | 117.8° |
C39 | C36 | C33 | H19 | 113.5° | 119.7° |
C39 | C36 | H20 | H21 | 122.9° | 122.7° |
C36 | C39 | C41 | H23 | 172.8° | 61.6° |
C36 | C39 | C41 | H24 | 61.3° | 171.5° |
C36 | C39 | C44 | H25 | 53.7° | 48.3° |
C28 | N30 | C31 | C41 | 159.5° | 145.5° |
N30 | C28 | C17 | C14 | 100.4° | 173.1° |
C28 | N30 | C31 | C33 | 94.7° | 110.2° |
N30 | C28 | C17 | C19 | 135.1° | 67.0° |
N30 | C28 | C17 | H1 | 16.9° | 53.1° |
C28 | N30 | C31 | H17 | 34.4° | 18.4° |
C28 | N30 | C44 | H25 | 46.9° | 62.0° |
C31 | N30 | C28 | C17 | 5.0° | 5.1° |
N30 | C31 | C41 | C33 | 111.1° | 107.4° |
N30 | C31 | C41 | H17 | 125.7° | 126.4° |
N30 | C31 | C33 | H17 | 129.5° | 128.6° |
N30 | C31 | C33 | C36 | 66.0° | 70.8° |
N30 | C31 | C33 | H18 | 52.9° | 48.0° |
N30 | C31 | C33 | H19 | 175.2° | 170.4° |
N30 | C31 | C41 | H23 | 65.6° | 169.6° |
N30 | C31 | C41 | H24 | 168.5° | 63.5° |
C31 | N30 | C44 | H25 | 125.8° | 118.3° |
C28 | C17 | C14 | C11 | 134.7° | 173.8° |
C28 | C17 | C14 | C19 | 122.0° | 120.0° |
C28 | C17 | C14 | H1 | 117.7° | 120.0° |
C28 | C17 | C19 | H1 | 118.3° | 120.1° |
C28 | C17 | C19 | C22 | 72.9° | 54.8° |
C28 | C17 | C14 | H11 | 103.7° | 66.2° |
C28 | C17 | C14 | H12 | 13.1° | 53.8° |
C28 | C17 | C19 | H13 | 47.5° | 174.8° |
C28 | C17 | C19 | H14 | 166.7° | 65.2° |
C41 | C31 | C33 | H17 | 123.2° | 126.8° |
C41 | C31 | C33 | C36 | 41.4° | 33.9° |
C41 | C31 | C33 | H18 | 160.2° | 152.7° |
C41 | C31 | C33 | H19 | 77.5° | 85.0° |
C31 | C41 | C39 | H22 | 179.9° | 178.2° |
C31 | C41 | H23 | H24 | 128.0° | 127.1° |
C11 | C14 | C17 | H11 | 121.6° | 120.1° |
C11 | C14 | C17 | H12 | 121.6° | 120.0° |
C14 | C11 | C08 | H9 | 120.8° | 120.0° |
C14 | C11 | C08 | H10 | 120.7° | 120.0° |
C14 | C11 | C08 | C05 | 158.6° | 180.0° |
C11 | C14 | C17 | C19 | 12.7° | 66.3° |
C11 | C14 | C17 | H1 | 107.6° | 53.7° |
C14 | C11 | C08 | H7 | 38.0° | 60.0° |
C14 | C11 | C08 | H8 | 80.8° | 60.0° |
C14 | C11 | H9 | H10 | 117.8° | 120.0° |
C11 | C14 | H11 | H12 | 114.8° | 120.0° |
C17 | C14 | C11 | C08 | 123.6° | 174.8° |
C14 | C17 | C19 | H1 | 120.2° | 120.0° |
C14 | C17 | C19 | C22 | 165.6° | 65.1° |
C17 | C14 | C11 | H9 | 2.8° | 65.2° |
C17 | C14 | C11 | H10 | 115.7° | 54.8° |
C17 | C14 | H11 | H12 | 114.9° | 120.0° |
C14 | C17 | C19 | H13 | 74.0° | 54.9° |
C14 | C17 | C19 | H14 | 45.2° | 174.8° |
C11 | C08 | C05 | H7 | 120.6° | 120.0° |
C11 | C08 | C05 | H8 | 120.6° | 120.0° |
C11 | C08 | C05 | C01 | 144.0° | 180.0° |
C11 | C08 | C05 | H5 | 23.4° | 60.0° |
C11 | C08 | C05 | H6 | 95.4° | 60.0° |
C11 | C08 | H7 | H8 | 118.2° | 120.0° |
C08 | C11 | H9 | H10 | 117.7° | 120.0° |
C08 | C11 | C14 | H11 | 2.0° | 65.2° |
C08 | C11 | C14 | H12 | 114.8° | 54.8° |
C08 | C05 | C01 | H5 | 120.6° | 120.0° |
C08 | C05 | C01 | H6 | 120.6° | 120.0° |
C08 | C05 | C01 | H2 | 180.0° | 60.0° |
C08 | C05 | C01 | H3 | 60.0° | 60.0° |
C08 | C05 | C01 | H4 | 60.0° | 180.0° |
C08 | C05 | H5 | H6 | 118.2° | 120.0° |
C05 | C08 | H7 | H8 | 118.1° | 120.0° |
C05 | C08 | C11 | H9 | 80.7° | 60.0° |
C05 | C08 | C11 | H10 | 37.8° | 60.0° |
C05 | C01 | H2 | H3 | 120.0° | 120.0° |
C05 | C01 | H2 | H4 | 120.0° | 120.0° |
C05 | C01 | H3 | H4 | 120.0° | 120.0° |
C01 | C05 | H5 | H6 | 118.2° | 120.0° |
C01 | C05 | C08 | H7 | 95.4° | 60.0° |
C01 | C05 | C08 | H8 | 23.4° | 60.0° |
C31 | C33 | C36 | H18 | 118.8° | 118.7° |
C31 | C33 | C36 | H19 | 118.8° | 118.7° |
C31 | C33 | H18 | H19 | 123.4° | 122.3° |
C31 | C33 | C36 | H20 | 124.4° | 119.6° |
C31 | C33 | C36 | H21 | 113.6° | 117.8° |
C33 | C31 | C41 | H23 | 176.7° | 62.1° |
C33 | C31 | C41 | H24 | 57.5° | 170.9° |
C17 | C19 | C22 | H13 | 120.4° | 120.0° |
C17 | C19 | C22 | H14 | 120.4° | 120.0° |
C17 | C19 | C22 | N24 | 151.4° | 175.2° |
C17 | C19 | C22 | O23 | 30.0° | 4.8° |
C19 | C17 | C14 | H11 | 134.3° | 53.8° |
C19 | C17 | C14 | H12 | 108.9° | 173.8° |
C17 | C19 | H13 | H14 | 118.8° | 120.0° |
C36 | C33 | C31 | H17 | 164.6° | 160.7° |
C36 | C33 | H18 | H19 | 123.4° | 122.6° |
C33 | C36 | H20 | H21 | 122.9° | 122.6° |
C33 | C36 | C39 | H22 | 156.4° | 162.4° |
C19 | C22 | N24 | O23 | 178.7° | 180.0° |
C19 | C22 | N24 | O26 | 179.5° | 175.0° |
C22 | C19 | C17 | H1 | 45.4° | 174.9° |
C22 | C19 | H13 | H14 | 118.8° | 120.0° |
C19 | C22 | N24 | H15 | 0.5° | 5.0° |
C22 | N24 | O26 | H15 | 180.0° | 180.0° |
N24 | C22 | C19 | H13 | 31.0° | 64.8° |
N24 | C22 | C19 | H14 | 88.2° | 55.2° |
C22 | N24 | O26 | H16 | 0.4° | 180.0° |
O23 | C22 | N24 | O26 | 0.8° | 5.0° |
O23 | C22 | C19 | H13 | 150.4° | 115.3° |
O23 | C22 | C19 | H14 | 90.5° | 124.8° |
O23 | C22 | N24 | H15 | 179.1° | 175.0° |
H1 | C17 | C14 | H11 | 13.9° | 173.8° |
H1 | C17 | C14 | H12 | 130.8° | 66.2° |
H1 | C17 | C19 | H13 | 165.8° | 65.1° |
H1 | C17 | C19 | H14 | 75.0° | 54.9° |
H2 | C01 | H3 | H4 | 120.0° | 120.0° |
H2 | C01 | C05 | H5 | 59.4° | 60.0° |
H2 | C01 | C05 | H6 | 59.4° | 180.0° |
H3 | C01 | C05 | H5 | 179.4° | 180.0° |
H3 | C01 | C05 | H6 | 60.6° | 60.0° |
H4 | C01 | C05 | H5 | 60.6° | 60.0° |
H4 | C01 | C05 | H6 | 179.4° | 60.0° |
H5 | C05 | C08 | H7 | 144.0° | 180.0° |
H5 | C05 | C08 | H8 | 97.2° | 60.0° |
H6 | C05 | C08 | H7 | 25.2° | 60.0° |
H6 | C05 | C08 | H8 | 144.0° | NaN° |
H7 | C08 | C11 | H9 | 158.7° | 180.0° |
H7 | C08 | C11 | H10 | 82.8° | 60.0° |
H8 | C08 | C11 | H9 | 39.9° | 60.0° |
H8 | C08 | C11 | H10 | 158.4° | 180.0° |
H9 | C11 | C14 | H11 | 118.8° | 54.8° |
H9 | C11 | C14 | H12 | 124.5° | 174.8° |
H10 | C11 | C14 | H11 | 122.7° | 174.8° |
H10 | C11 | C14 | H12 | 5.9° | 65.2° |
H15 | N24 | O26 | H16 | 179.6° | 0.0° |
H17 | C31 | C33 | H18 | 76.6° | 80.6° |
H17 | C31 | C33 | H19 | 45.7° | 41.8° |
H17 | C31 | C41 | H23 | 60.1° | 64.0° |
H17 | C31 | C41 | H24 | 65.8° | 63.0° |
H18 | C33 | C36 | H20 | 116.7° | 0.8° |
H18 | C33 | C36 | H21 | 5.2° | 123.5° |
H19 | C33 | C36 | H20 | 5.6° | 121.7° |
H19 | C33 | C36 | H21 | 127.5° | 0.9° |
H20 | C36 | C39 | H22 | 37.4° | 79.0° |
H21 | C36 | C39 | H22 | 84.6° | 43.7° |
H22 | C39 | C41 | H23 | 63.0° | 65.2° |
H22 | C39 | C41 | H24 | 62.8° | 61.7° |
H22 | C39 | C44 | H25 | 76.2° | 81.7° |
H26 | N48 | C50 | H27 | 141.8° | 141.5° |
H29 | C57 | C59 | H30 | 0.6° | 0.1° |
H30 | C59 | C61 | H31 | 0.2° | 0.1° |
H31 | C61 | C63 | H32 | 0.1° | 0.0° |
H32 | C63 | C65 | H33 | 0.4° | 0.3° |