Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.51Å | 1.52Å | |
C1 | H11 | sing | 1.09Å | 1.12Å | |
C1 | H12 | sing | 1.09Å | 1.11Å | |
C1 | H13A | sing | 1.09Å | 1.11Å | |
C2 | O3 | doub | 1.21Å | 1.24Å | |
C2 | N4 | sing | 1.35Å | 1.33Å | |
N4 | C5 | sing | 1.47Å | 1.47Å | |
N4 | HN4 | sing | 0.97Å | 1.02Å | |
C5 | C6 | sing | 1.53Å | 1.54Å | |
C5 | C17 | sing | 1.51Å | 1.54Å | |
C5 | H5 | sing | 1.09Å | 1.11Å | |
C6 | C7 | sing | 1.51Å | 1.50Å | |
C6 | H61 | sing | 1.09Å | 1.12Å | |
C6 | H62 | sing | 1.09Å | 1.12Å | |
C7 | C8 | doub | 1.36Å | 1.38Å | Aromatic |
C7 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
C8 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
C8 | H8 | sing | 1.08Å | 1.10Å | |
C9 | C10 | doub | 1.36Å | 1.39Å | Aromatic |
C9 | H9 | sing | 1.08Å | 1.10Å | |
C10 | C12 | sing | 1.41Å | 1.41Å | Aromatic |
C10 | H10 | sing | 1.08Å | 1.10Å | |
C11 | C12 | doub | 1.42Å | 1.42Å | Aromatic |
C11 | C13 | sing | 1.41Å | 1.40Å | Aromatic |
C12 | C14 | sing | 1.41Å | 1.40Å | Aromatic |
C13 | C15 | doub | 1.36Å | 1.37Å | Aromatic |
C13 | H13 | sing | 1.08Å | 1.10Å | |
C14 | C16 | doub | 1.36Å | 1.37Å | Aromatic |
C14 | H14 | sing | 1.08Å | 1.10Å | |
C15 | C16 | sing | 1.39Å | 1.37Å | Aromatic |
C15 | H15 | sing | 1.08Å | 1.10Å | |
C16 | H16 | sing | 1.08Å | 1.10Å | |
C17 | O18 | doub | 1.21Å | 1.22Å | |
C17 | N19 | sing | 1.35Å | 1.29Å | |
N19 | C20 | sing | 1.46Å | 1.42Å | |
N19 | HNJ | sing | 0.97Å | 1.02Å | |
C20 | C21 | sing | 1.51Å | 1.53Å | |
C20 | C23 | sing | 1.53Å | 1.55Å | |
C20 | H20 | sing | 1.09Å | 1.12Å | |
C21 | O22 | doub | 1.21Å | 1.23Å | |
C21 | N26 | sing | 1.35Å | 1.31Å | |
C23 | C24 | sing | 1.53Å | 1.52Å | |
C23 | C25 | sing | 1.53Å | 1.52Å | |
C23 | H23 | sing | 1.09Å | 1.11Å | |
C24 | H241 | sing | 1.09Å | 1.11Å | |
C24 | H242 | sing | 1.09Å | 1.12Å | |
C24 | H243 | sing | 1.09Å | 1.12Å | |
C25 | H251 | sing | 1.09Å | 1.11Å | |
C25 | H252 | sing | 1.09Å | 1.12Å | |
C25 | H253 | sing | 1.09Å | 1.11Å | |
N26 | C27 | sing | 1.47Å | 1.43Å | |
N26 | HNQ | sing | 0.97Å | 1.02Å | |
C27 | C28 | sing | 1.53Å | 1.56Å | |
C27 | C32 | sing | 1.53Å | 1.57Å | |
C27 | H27 | sing | 1.09Å | 1.11Å | |
C28 | C29 | sing | 1.53Å | 1.58Å | |
C28 | H281 | sing | 1.09Å | 1.12Å | |
C28 | H282 | sing | 1.09Å | 1.11Å | |
C29 | C30 | sing | 1.53Å | 1.48Å | |
C29 | C31 | sing | 1.53Å | 1.50Å | |
C29 | H29 | sing | 1.09Å | 1.11Å | |
C30 | H301 | sing | 1.09Å | 1.11Å | |
C30 | H302 | sing | 1.09Å | 1.12Å | |
C30 | H303 | sing | 1.09Å | 1.12Å | |
C31 | H311 | sing | 1.09Å | 1.11Å | |
C31 | H312 | sing | 1.09Å | 1.11Å | |
C31 | H313 | sing | 1.09Å | 1.12Å | |
C32 | C33 | sing | 1.53Å | 1.54Å | |
C32 | O34 | sing | 1.43Å | 1.43Å | |
C32 | H32 | sing | 1.09Å | 1.11Å | |
C33 | C35 | sing | 1.51Å | 1.53Å | |
C33 | H331 | sing | 1.09Å | 1.12Å | |
C33 | H332 | sing | 1.09Å | 1.11Å | |
O34 | HOY | sing | 0.97Å | 0.95Å | |
C35 | O36 | doub | 1.21Å | 1.24Å | |
C35 | N37 | sing | 1.35Å | 1.33Å | |
N37 | C38 | sing | 1.47Å | 1.45Å | |
N37 | HN7 | sing | 0.97Å | 1.02Å | |
C38 | C39 | sing | 1.53Å | 1.54Å | |
C38 | C41 | sing | 1.51Å | 1.52Å | |
C38 | H38 | sing | 1.09Å | 1.11Å | |
C39 | C40 | sing | 1.53Å | 1.50Å | |
C39 | H391 | sing | 1.09Å | 1.12Å | |
C39 | H392 | sing | 1.09Å | 1.11Å | |
C40 | H401 | sing | 1.09Å | 1.12Å | |
C40 | H402 | sing | 1.09Å | 1.11Å | |
C40 | H403 | sing | 1.09Å | 1.11Å | |
C41 | O42 | doub | 1.21Å | 1.25Å | |
C41 | N43 | sing | 1.35Å | 1.34Å | |
N43 | C44 | sing | 1.46Å | 1.45Å | |
N43 | HN3 | sing | 0.97Å | 1.02Å | |
C44 | C45 | sing | 1.53Å | 1.55Å | |
C44 | C56 | sing | 1.51Å | 1.52Å | |
C44 | H44 | sing | 1.09Å | 1.12Å | |
C45 | C46 | sing | 1.51Å | 1.53Å | |
C45 | H451 | sing | 1.09Å | 1.11Å | |
C45 | H452 | sing | 1.09Å | 1.12Å | |
C46 | C47 | doub | 1.36Å | 1.39Å | Aromatic |
C46 | C50 | sing | 1.40Å | 1.40Å | Aromatic |
C47 | C48 | sing | 1.39Å | 1.40Å | Aromatic |
C47 | H47 | sing | 1.08Å | 1.10Å | |
C48 | C49 | doub | 1.36Å | 1.38Å | Aromatic |
C48 | H48 | sing | 1.08Å | 1.10Å | |
C49 | C51 | sing | 1.40Å | 1.40Å | Aromatic |
C49 | H49 | sing | 1.08Å | 1.10Å | |
C50 | C51 | doub | 1.42Å | 1.43Å | Aromatic |
C50 | C52 | sing | 1.41Å | 1.40Å | Aromatic |
C51 | C53 | sing | 1.41Å | 1.40Å | Aromatic |
C52 | C54 | doub | 1.36Å | 1.39Å | Aromatic |
C52 | H52 | sing | 1.08Å | 1.10Å | |
C53 | C55 | doub | 1.36Å | 1.39Å | Aromatic |
C53 | H53 | sing | 1.08Å | 1.10Å | |
C54 | C55 | sing | 1.39Å | 1.38Å | Aromatic |
C54 | H54 | sing | 1.08Å | 1.10Å | |
C55 | H55 | sing | 1.08Å | 1.10Å | |
C56 | O57 | doub | 1.21Å | 1.24Å | |
C56 | N58 | sing | 1.35Å | 1.32Å | |
N58 | HN1 | sing | 0.97Å | 1.02Å | |
N58 | HN2 | sing | 0.97Å | 1.02Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | H11 | 122.6° | 109.5° |
C2 | C1 | H12 | 107.5° | 109.5° |
C2 | C1 | H13A | 107.5° | 109.5° |
C1 | C2 | O3 | 122.6° | 120.0° |
C1 | C2 | N4 | 113.6° | 120.0° |
H11 | C1 | H12 | 107.5° | 109.5° |
H11 | C1 | H13A | 107.5° | 109.5° |
H12 | C1 | H13A | 102.3° | 109.5° |
O3 | C2 | N4 | 123.7° | 120.0° |
C2 | N4 | C5 | 118.9° | 120.0° |
C2 | N4 | HN4 | 115.9° | 120.0° |
C5 | N4 | HN4 | 125.2° | 120.0° |
N4 | C5 | C6 | 114.2° | 109.4° |
N4 | C5 | C17 | 109.5° | 109.4° |
N4 | C5 | H5 | 104.0° | 109.4° |
C6 | C5 | C17 | 101.0° | 109.5° |
C6 | C5 | H5 | 112.0° | 109.6° |
C5 | C6 | C7 | 113.7° | 109.5° |
C5 | C6 | H61 | 110.7° | 109.6° |
C5 | C6 | H62 | 110.7° | 109.4° |
C17 | C5 | H5 | 116.5° | 109.5° |
C5 | C17 | O18 | 118.5° | 120.0° |
C5 | C17 | N19 | 114.9° | 120.0° |
C7 | C6 | H61 | 110.7° | 109.5° |
C7 | C6 | H62 | 110.7° | 109.4° |
C6 | C7 | C8 | 119.9° | 120.1° |
C6 | C7 | C11 | 120.1° | 120.2° |
H61 | C6 | H62 | 99.6° | 109.5° |
C8 | C7 | C11 | 120.0° | 119.6° |
C7 | C8 | C9 | 120.6° | 121.0° |
C7 | C8 | H8 | 119.2° | 119.5° |
C7 | C11 | C12 | 119.9° | 119.3° |
C7 | C11 | C13 | 121.1° | 121.3° |
C9 | C8 | H8 | 120.2° | 119.5° |
C8 | C9 | C10 | 120.7° | 121.0° |
C8 | C9 | H9 | 119.8° | 119.5° |
C10 | C9 | H9 | 119.5° | 119.5° |
C9 | C10 | C12 | 119.3° | 119.6° |
C9 | C10 | H10 | 119.6° | 120.2° |
C12 | C10 | H10 | 121.1° | 120.2° |
C10 | C12 | C11 | 119.5° | 119.4° |
C10 | C12 | C14 | 120.5° | 121.3° |
C12 | C11 | C13 | 119.1° | 119.4° |
C11 | C12 | C14 | 120.1° | 119.3° |
C11 | C13 | C15 | 119.8° | 119.7° |
C11 | C13 | H13 | 121.1° | 120.2° |
C12 | C14 | C16 | 118.3° | 119.6° |
C12 | C14 | H14 | 121.9° | 120.2° |
C15 | C13 | H13 | 119.1° | 120.1° |
C13 | C15 | C16 | 120.5° | 120.9° |
C13 | C15 | H15 | 119.7° | 119.5° |
C16 | C14 | H14 | 119.8° | 120.2° |
C14 | C16 | C15 | 122.3° | 121.0° |
C14 | C16 | H16 | 118.9° | 119.5° |
C16 | C15 | H15 | 119.9° | 119.5° |
C15 | C16 | H16 | 118.9° | 119.5° |
O18 | C17 | N19 | 126.3° | 120.0° |
C17 | N19 | C20 | 128.7° | 120.0° |
C17 | N19 | HNJ | 109.9° | 120.0° |
C20 | N19 | HNJ | 121.3° | 120.1° |
N19 | C20 | C21 | 106.5° | 109.4° |
N19 | C20 | C23 | 115.9° | 109.5° |
N19 | C20 | H20 | 108.0° | 109.5° |
C21 | C20 | C23 | 111.9° | 109.5° |
C21 | C20 | H20 | 112.4° | 109.5° |
C20 | C21 | O22 | 124.3° | 120.0° |
C20 | C21 | N26 | 114.7° | 120.0° |
C23 | C20 | H20 | 102.2° | 109.5° |
C20 | C23 | C24 | 109.7° | 109.5° |
C20 | C23 | C25 | 109.9° | 109.5° |
C20 | C23 | H23 | 107.2° | 109.5° |
O22 | C21 | N26 | 121.0° | 120.0° |
C21 | N26 | C27 | 128.5° | 120.1° |
C21 | N26 | HNQ | 110.8° | 120.0° |
C24 | C23 | C25 | 103.0° | 109.5° |
C24 | C23 | H23 | 113.6° | 109.5° |
C23 | C24 | H241 | 109.7° | 109.5° |
C23 | C24 | H242 | 112.1° | 109.4° |
C23 | C24 | H243 | 112.1° | 109.5° |
C25 | C23 | H23 | 113.5° | 109.5° |
C23 | C25 | H251 | 109.9° | 109.5° |
C23 | C25 | H252 | 112.0° | 109.5° |
C23 | C25 | H253 | 112.1° | 109.5° |
H241 | C24 | H242 | 112.1° | 109.4° |
H241 | C24 | H243 | 112.1° | 109.5° |
H242 | C24 | H243 | 98.3° | 109.5° |
H251 | C25 | H252 | 112.1° | 109.4° |
H251 | C25 | H253 | 112.1° | 109.5° |
H252 | C25 | H253 | 98.3° | 109.5° |
C27 | N26 | HNQ | 120.8° | 120.0° |
N26 | C27 | C28 | 107.3° | 109.5° |
N26 | C27 | C32 | 115.3° | 109.5° |
N26 | C27 | H27 | 109.3° | 109.4° |
C28 | C27 | C32 | 115.4° | 109.5° |
C28 | C27 | H27 | 109.2° | 109.5° |
C27 | C28 | C29 | 110.8° | 109.5° |
C27 | C28 | H281 | 111.7° | 109.5° |
C27 | C28 | H282 | 111.7° | 109.5° |
C32 | C27 | H27 | 100.0° | 109.5° |
C27 | C32 | C33 | 113.1° | 109.5° |
C27 | C32 | O34 | 111.2° | 109.5° |
C27 | C32 | H32 | 105.1° | 109.5° |
C29 | C28 | H281 | 111.8° | 109.4° |
C29 | C28 | H282 | 111.7° | 109.5° |
C28 | C29 | C30 | 111.4° | 109.5° |
C28 | C29 | C31 | 108.5° | 109.4° |
C28 | C29 | H29 | 110.8° | 109.5° |
H281 | C28 | H282 | 98.7° | 109.4° |
C30 | C29 | C31 | 114.8° | 109.5° |
C30 | C29 | H29 | 104.0° | 109.5° |
C29 | C30 | H301 | 111.4° | 109.5° |
C29 | C30 | H302 | 111.5° | 109.4° |
C29 | C30 | H303 | 111.5° | 109.5° |
C31 | C29 | H29 | 107.2° | 109.4° |
C29 | C31 | H311 | 108.4° | 109.5° |
C29 | C31 | H312 | 112.5° | 109.5° |
C29 | C31 | H313 | 112.5° | 109.5° |
H301 | C30 | H302 | 111.5° | 109.4° |
H301 | C30 | H303 | 111.6° | 109.5° |
H302 | C30 | H303 | 98.9° | 109.5° |
H311 | C31 | H312 | 112.7° | 109.5° |
H311 | C31 | H313 | 112.6° | 109.4° |
H312 | C31 | H313 | 97.9° | 109.5° |
C33 | C32 | O34 | 107.2° | 109.5° |
C33 | C32 | H32 | 109.1° | 109.4° |
C32 | C33 | C35 | 115.4° | 109.4° |
C32 | C33 | H331 | 110.0° | 109.5° |
C32 | C33 | H332 | 110.0° | 109.5° |
O34 | C32 | H32 | 111.2° | 109.5° |
C32 | O34 | HOY | 111.2° | 106.8° |
C35 | C33 | H331 | 110.1° | 109.5° |
C35 | C33 | H332 | 110.0° | 109.5° |
C33 | C35 | O36 | 127.1° | 120.1° |
C33 | C35 | N37 | 110.0° | 120.0° |
H331 | C33 | H332 | 100.2° | 109.5° |
O36 | C35 | N37 | 122.8° | 120.0° |
C35 | N37 | C38 | 124.7° | 120.0° |
C35 | N37 | HN7 | 112.9° | 120.0° |
C38 | N37 | HN7 | 122.4° | 120.0° |
N37 | C38 | C39 | 107.1° | 109.5° |
N37 | C38 | C41 | 110.8° | 109.5° |
N37 | C38 | H38 | 110.2° | 109.5° |
C39 | C38 | C41 | 109.6° | 109.5° |
C39 | C38 | H38 | 111.3° | 109.4° |
C38 | C39 | C40 | 118.2° | 109.5° |
C38 | C39 | H391 | 109.0° | 109.4° |
C38 | C39 | H392 | 109.0° | 109.4° |
C41 | C38 | H38 | 107.8° | 109.4° |
C38 | C41 | O42 | 118.2° | 120.0° |
C38 | C41 | N43 | 118.1° | 120.1° |
C40 | C39 | H391 | 109.1° | 109.5° |
C40 | C39 | H392 | 109.1° | 109.5° |
C39 | C40 | H401 | 118.1° | 109.5° |
C39 | C40 | H402 | 109.0° | 109.5° |
C39 | C40 | H403 | 109.0° | 109.4° |
H391 | C39 | H392 | 101.0° | 109.5° |
H401 | C40 | H402 | 109.1° | 109.4° |
H401 | C40 | H403 | 109.1° | 109.5° |
H402 | C40 | H403 | 101.1° | 109.5° |
O42 | C41 | N43 | 123.6° | 120.0° |
C41 | N43 | C44 | 121.7° | 120.0° |
C41 | N43 | HN3 | 115.1° | 120.0° |
C44 | N43 | HN3 | 123.2° | 120.0° |
N43 | C44 | C45 | 116.2° | 109.5° |
N43 | C44 | C56 | 113.2° | 109.5° |
N43 | C44 | H44 | 102.7° | 109.4° |
C45 | C44 | C56 | 112.7° | 109.5° |
C45 | C44 | H44 | 103.4° | 109.5° |
C44 | C45 | C46 | 112.1° | 109.5° |
C44 | C45 | H451 | 111.2° | 109.4° |
C44 | C45 | H452 | 111.2° | 109.5° |
C56 | C44 | H44 | 107.2° | 109.5° |
C44 | C56 | O57 | 121.1° | 120.0° |
C44 | C56 | N58 | 119.1° | 120.0° |
C46 | C45 | H451 | 111.2° | 109.5° |
C46 | C45 | H452 | 111.2° | 109.5° |
C45 | C46 | C47 | 119.9° | 120.2° |
C45 | C46 | C50 | 121.3° | 120.2° |
H451 | C45 | H452 | 99.2° | 109.4° |
C47 | C46 | C50 | 118.7° | 119.7° |
C46 | C47 | C48 | 120.9° | 121.0° |
C46 | C47 | H47 | 119.1° | 119.5° |
C46 | C50 | C51 | 120.7° | 119.4° |
C46 | C50 | C52 | 120.0° | 121.3° |
C48 | C47 | H47 | 120.0° | 119.5° |
C47 | C48 | C49 | 120.5° | 121.0° |
C47 | C48 | H48 | 120.6° | 119.6° |
C49 | C48 | H48 | 118.9° | 119.4° |
C48 | C49 | C51 | 120.4° | 119.6° |
C48 | C49 | H49 | 119.1° | 120.2° |
C51 | C49 | H49 | 120.5° | 120.2° |
C49 | C51 | C50 | 118.7° | 119.4° |
C49 | C51 | C53 | 121.3° | 121.3° |
C51 | C50 | C52 | 119.2° | 119.3° |
C50 | C51 | C53 | 120.0° | 119.4° |
C50 | C52 | C54 | 119.8° | 119.6° |
C50 | C52 | H52 | 120.8° | 120.2° |
C51 | C53 | C55 | 118.6° | 119.6° |
C51 | C53 | H53 | 121.1° | 120.2° |
C54 | C52 | H52 | 119.4° | 120.2° |
C52 | C54 | C55 | 120.3° | 121.0° |
C52 | C54 | H54 | 120.1° | 119.5° |
C55 | C53 | H53 | 120.3° | 120.2° |
C53 | C55 | C54 | 122.1° | 121.0° |
C53 | C55 | H55 | 119.3° | 119.5° |
C55 | C54 | H54 | 119.6° | 119.5° |
C54 | C55 | H55 | 118.6° | 119.5° |
O57 | C56 | N58 | 119.8° | 120.0° |
C56 | N58 | HN1 | 119.7° | 120.0° |
C56 | N58 | HN2 | 119.1° | 120.0° |
HN1 | N58 | HN2 | 121.1° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | H11 | H12 | 125.3° | 120.0° |
C2 | C1 | H11 | H13A | 125.2° | 120.0° |
C2 | C1 | H12 | H13A | 113.1° | 120.0° |
C1 | C2 | O3 | N4 | 178.5° | 179.9° |
C1 | C2 | N4 | C5 | 178.9° | 180.0° |
C1 | C2 | N4 | HN4 | 1.1° | 0.0° |
H11 | C1 | H12 | H13A | 113.1° | 120.0° |
H11 | C1 | C2 | O3 | 180.0° | 120.0° |
H11 | C1 | C2 | N4 | 1.3° | 60.0° |
H12 | C1 | C2 | O3 | 54.8° | 0.0° |
H12 | C1 | C2 | N4 | 126.6° | 180.0° |
H13A | C1 | C2 | O3 | 54.8° | 120.0° |
H13A | C1 | C2 | N4 | 123.9° | 60.0° |
O3 | C2 | N4 | C5 | 0.3° | 0.1° |
O3 | C2 | N4 | HN4 | 179.7° | 180.0° |
C2 | N4 | C5 | HN4 | 180.0° | 180.0° |
C2 | N4 | C5 | C6 | 128.0° | 60.0° |
C2 | N4 | C5 | C17 | 119.5° | 60.0° |
C2 | N4 | C5 | H5 | 5.7° | 180.0° |
N4 | C5 | C6 | C17 | 117.4° | 119.9° |
N4 | C5 | C6 | H5 | 117.9° | 120.0° |
N4 | C5 | C17 | H5 | 117.6° | 119.9° |
N4 | C5 | C6 | C7 | 81.4° | 60.1° |
N4 | C5 | C6 | H61 | 43.9° | 60.0° |
N4 | C5 | C6 | H62 | 153.3° | 180.0° |
N4 | C5 | C17 | O18 | 46.6° | 30.0° |
N4 | C5 | C17 | N19 | 139.8° | 150.0° |
HN4 | N4 | C5 | C6 | 52.0° | 120.0° |
HN4 | N4 | C5 | C17 | 60.5° | 120.0° |
HN4 | N4 | C5 | H5 | 174.3° | 0.0° |
C6 | C5 | C17 | H5 | 121.6° | 120.1° |
C5 | C6 | C7 | H61 | 125.3° | 120.1° |
C5 | C6 | C7 | H62 | 125.3° | 119.9° |
C5 | C6 | H61 | H62 | 116.5° | 120.0° |
C5 | C6 | C7 | C8 | 16.1° | 90.1° |
C5 | C6 | C7 | C11 | 161.2° | 90.2° |
C6 | C5 | C17 | O18 | 74.3° | 89.9° |
C6 | C5 | C17 | N19 | 99.4° | 90.0° |
C17 | C5 | C6 | C7 | 161.2° | 180.0° |
C17 | C5 | C6 | H61 | 73.5° | 59.9° |
C17 | C5 | C6 | H62 | 35.9° | 60.1° |
C5 | C17 | O18 | N19 | 172.9° | 179.9° |
C5 | C17 | N19 | C20 | 175.1° | 180.0° |
C5 | C17 | N19 | HNJ | 4.9° | 0.0° |
H5 | C5 | C6 | C7 | 36.5° | 59.9° |
H5 | C5 | C6 | H61 | 161.8° | NaN° |
H5 | C5 | C6 | H62 | 88.8° | 60.0° |
H5 | C5 | C17 | O18 | 164.1° | 150.0° |
H5 | C5 | C17 | N19 | 22.2° | 30.1° |
C7 | C6 | H61 | H62 | 116.5° | 119.9° |
C6 | C7 | C8 | C11 | 177.3° | 179.8° |
C6 | C7 | C8 | C9 | 178.0° | 180.0° |
C6 | C7 | C8 | H8 | 2.0° | 0.0° |
C6 | C7 | C11 | C12 | 178.0° | 179.7° |
C6 | C7 | C11 | C13 | 0.9° | 0.5° |
H61 | C6 | C7 | C8 | 141.4° | 30.1° |
H61 | C6 | C7 | C11 | 35.9° | 149.7° |
H62 | C6 | C7 | C8 | 109.1° | 150.0° |
H62 | C6 | C7 | C11 | 73.5° | 29.7° |
C7 | C8 | C9 | H8 | 179.9° | 179.9° |
C7 | C8 | C9 | C10 | 0.2° | 0.1° |
C7 | C8 | C9 | H9 | 179.7° | 180.0° |
C8 | C7 | C11 | C12 | 0.7° | 0.5° |
C8 | C7 | C11 | C13 | 178.2° | 179.7° |
C11 | C7 | C8 | C9 | 0.7° | 0.3° |
C11 | C7 | C8 | H8 | 179.4° | 179.8° |
C7 | C11 | C12 | C10 | 0.2° | 0.5° |
C7 | C11 | C12 | C13 | 178.9° | 179.2° |
C7 | C11 | C12 | C14 | 178.7° | 179.8° |
C7 | C11 | C13 | C15 | 179.4° | 179.7° |
C7 | C11 | C13 | H13 | 0.6° | 0.4° |
C8 | C9 | C10 | H9 | 180.0° | 180.0° |
C8 | C9 | C10 | C12 | 0.2° | 0.1° |
C8 | C9 | C10 | H10 | 179.7° | 180.0° |
H8 | C8 | C9 | C10 | 179.8° | 180.0° |
H8 | C8 | C9 | H9 | 0.2° | 0.0° |
C9 | C10 | C12 | H10 | 180.0° | 179.9° |
C9 | C10 | C12 | C11 | 0.2° | 0.3° |
C9 | C10 | C12 | C14 | 178.3° | 180.0° |
H9 | C9 | C10 | C12 | 179.8° | 179.9° |
H9 | C9 | C10 | H10 | 0.2° | 0.0° |
C10 | C12 | C11 | C14 | 178.5° | 179.7° |
C10 | C12 | C11 | C13 | 178.7° | 179.8° |
C10 | C12 | C14 | C16 | 179.5° | 180.0° |
C10 | C12 | C14 | H14 | 0.5° | 0.1° |
H10 | C10 | C12 | C11 | 179.7° | 179.8° |
H10 | C10 | C12 | C14 | 1.8° | 0.1° |
C12 | C11 | C13 | C15 | 1.7° | 0.5° |
C12 | C11 | C13 | H13 | 178.2° | 179.6° |
C11 | C12 | C14 | C16 | 2.0° | 0.3° |
C11 | C12 | C14 | H14 | 178.0° | 179.8° |
C13 | C11 | C12 | C14 | 0.2° | 0.5° |
C11 | C13 | C15 | H13 | 180.0° | 179.9° |
C11 | C13 | C15 | C16 | 1.8° | 0.2° |
C11 | C13 | C15 | H15 | 178.2° | 179.8° |
C12 | C14 | C16 | H14 | 180.0° | 180.0° |
C12 | C14 | C16 | C15 | 2.0° | 0.0° |
C12 | C14 | C16 | H16 | 178.0° | 180.0° |
C13 | C15 | C16 | C14 | 0.1° | 0.1° |
C13 | C15 | C16 | H15 | 180.0° | 180.0° |
C13 | C15 | C16 | H16 | 179.9° | 180.0° |
H13 | C13 | C15 | C16 | 178.2° | 179.9° |
H13 | C13 | C15 | H15 | 1.8° | 0.1° |
C14 | C16 | C15 | H16 | 180.0° | 179.9° |
C14 | C16 | C15 | H15 | 179.9° | 180.0° |
H14 | C14 | C16 | C15 | 178.0° | 179.9° |
H14 | C14 | C16 | H16 | 2.1° | 0.0° |
H15 | C15 | C16 | H16 | 0.1° | 0.1° |
O18 | C17 | N19 | C20 | 2.0° | 0.1° |
O18 | C17 | N19 | HNJ | 178.0° | 180.0° |
C17 | N19 | C20 | HNJ | 180.0° | 179.9° |
C17 | N19 | C20 | C21 | 132.3° | 150.0° |
C17 | N19 | C20 | C23 | 102.5° | 90.0° |
C17 | N19 | C20 | H20 | 11.4° | 30.1° |
N19 | C20 | C21 | C23 | 127.6° | 120.0° |
N19 | C20 | C21 | H20 | 118.1° | 119.9° |
N19 | C20 | C23 | H20 | 117.2° | 120.0° |
N19 | C20 | C21 | O22 | 75.8° | 15.4° |
N19 | C20 | C21 | N26 | 106.1° | 164.6° |
N19 | C20 | C23 | C24 | 176.2° | 65.9° |
N19 | C20 | C23 | C25 | 71.3° | 174.2° |
N19 | C20 | C23 | H23 | 52.5° | 54.2° |
HNJ | N19 | C20 | C21 | 47.7° | 30.1° |
HNJ | N19 | C20 | C23 | 77.5° | 90.0° |
HNJ | N19 | C20 | H20 | 168.6° | 150.0° |
C21 | C20 | C23 | H20 | 120.4° | 120.0° |
C20 | C21 | O22 | N26 | 178.1° | 180.0° |
C21 | C20 | C23 | C24 | 53.8° | 54.1° |
C21 | C20 | C23 | C25 | 166.3° | 65.9° |
C21 | C20 | C23 | H23 | 69.9° | 174.1° |
C20 | C21 | N26 | C27 | 179.9° | 174.1° |
C20 | C21 | N26 | HNQ | 0.1° | 5.8° |
C23 | C20 | C21 | O22 | 51.9° | 104.6° |
C23 | C20 | C21 | N26 | 126.3° | 75.4° |
C20 | C23 | C24 | C25 | 116.9° | 120.0° |
C20 | C23 | C24 | H23 | 119.9° | 120.0° |
C20 | C23 | C25 | H23 | 120.0° | 120.0° |
C20 | C23 | C24 | H241 | 180.0° | 180.0° |
C20 | C23 | C24 | H242 | 54.7° | 60.1° |
C20 | C23 | C24 | H243 | 54.7° | 60.0° |
C20 | C23 | C25 | H251 | 180.0° | 63.0° |
C20 | C23 | C25 | H252 | 54.7° | 57.0° |
C20 | C23 | C25 | H253 | 54.7° | 177.0° |
H20 | C20 | C21 | O22 | 166.1° | 135.4° |
H20 | C20 | C21 | N26 | 12.0° | 44.6° |
H20 | C20 | C23 | C24 | 66.6° | 174.1° |
H20 | C20 | C23 | C25 | 45.9° | 54.1° |
H20 | C20 | C23 | H23 | 169.7° | 65.9° |
O22 | C21 | N26 | C27 | 1.6° | 5.9° |
O22 | C21 | N26 | HNQ | 178.3° | 174.2° |
C21 | N26 | C27 | HNQ | 179.9° | 179.9° |
C21 | N26 | C27 | C28 | 115.9° | 100.5° |
C21 | N26 | C27 | C32 | 114.0° | 139.5° |
C21 | N26 | C27 | H27 | 2.4° | 19.5° |
C24 | C23 | C25 | H23 | 123.2° | 120.0° |
C23 | C24 | H241 | H242 | 125.3° | 119.9° |
C23 | C24 | H241 | H243 | 125.2° | 120.0° |
C23 | C24 | H242 | H243 | 118.0° | 120.0° |
C24 | C23 | C25 | H251 | 63.1° | 57.0° |
C24 | C23 | C25 | H252 | 62.1° | 177.0° |
C24 | C23 | C25 | H253 | 171.5° | 63.0° |
C25 | C23 | C24 | H241 | 63.0° | 60.0° |
C25 | C23 | C24 | H242 | 171.7° | 180.0° |
C25 | C23 | C24 | H243 | 62.2° | 60.0° |
C23 | C25 | H251 | H252 | 125.2° | 120.0° |
C23 | C25 | H251 | H253 | 125.3° | 120.0° |
C23 | C25 | H252 | H253 | 117.9° | 120.0° |
H23 | C23 | C24 | H241 | 60.1° | 60.0° |
H23 | C23 | C24 | H242 | 65.2° | 60.0° |
H23 | C23 | C24 | H243 | 174.6° | 180.0° |
H23 | C23 | C25 | H251 | 60.1° | 177.0° |
H23 | C23 | C25 | H252 | 174.7° | 63.0° |
H23 | C23 | C25 | H253 | 65.3° | 57.0° |
H241 | C24 | H242 | H243 | 118.0° | 120.0° |
H251 | C25 | H252 | H253 | 118.1° | 120.0° |
N26 | C27 | C28 | C32 | 130.0° | 120.0° |
N26 | C27 | C28 | H27 | 118.4° | 119.9° |
N26 | C27 | C32 | H27 | 117.0° | 119.9° |
N26 | C27 | C28 | C29 | 49.8° | 65.6° |
N26 | C27 | C28 | H281 | 75.4° | 54.3° |
N26 | C27 | C28 | H282 | 175.1° | 174.3° |
N26 | C27 | C32 | C33 | 84.1° | 60.0° |
N26 | C27 | C32 | O34 | 36.6° | 60.0° |
N26 | C27 | C32 | H32 | 157.0° | 180.0° |
HNQ | N26 | C27 | C28 | 64.1° | 79.5° |
HNQ | N26 | C27 | C32 | 65.9° | 40.6° |
HNQ | N26 | C27 | H27 | 177.5° | 160.6° |
C28 | C27 | C32 | H27 | 117.0° | 120.0° |
C27 | C28 | C29 | H281 | 125.2° | 120.0° |
C27 | C28 | C29 | H282 | 125.3° | 120.1° |
C27 | C28 | H281 | H282 | 117.6° | 120.1° |
C27 | C28 | C29 | C30 | 159.9° | 173.2° |
C27 | C28 | C29 | C31 | 72.8° | 66.9° |
C27 | C28 | C29 | H29 | 44.6° | 53.0° |
C28 | C27 | C32 | C33 | 149.9° | 180.0° |
C28 | C27 | C32 | O34 | 89.4° | 60.0° |
C28 | C27 | C32 | H32 | 30.9° | 60.0° |
C32 | C27 | C28 | C29 | 179.8° | 174.4° |
C32 | C27 | C28 | H281 | 54.6° | 65.7° |
C32 | C27 | C28 | H282 | 54.9° | 54.3° |
C27 | C32 | C33 | O34 | 122.9° | 120.0° |
C27 | C32 | C33 | H32 | 116.6° | 120.0° |
C27 | C32 | O34 | H32 | 116.7° | 120.0° |
C27 | C32 | C33 | C35 | 70.3° | 180.0° |
C27 | C32 | C33 | H331 | 164.4° | 60.0° |
C27 | C32 | C33 | H332 | 55.0° | 60.0° |
C27 | C32 | O34 | HOY | 180.0° | 60.0° |
H27 | C27 | C28 | C29 | 68.6° | 54.3° |
H27 | C27 | C28 | H281 | 166.2° | 174.2° |
H27 | C27 | C28 | H282 | 56.7° | 65.8° |
H27 | C27 | C32 | C33 | 32.9° | 59.9° |
H27 | C27 | C32 | O34 | 153.6° | 180.0° |
H27 | C27 | C32 | H32 | 86.0° | 60.0° |
C29 | C28 | H281 | H282 | 117.7° | 119.9° |
C28 | C29 | C30 | C31 | 123.8° | 119.9° |
C28 | C29 | C30 | H29 | 119.4° | 120.1° |
C28 | C29 | C31 | H29 | 119.7° | 120.0° |
C28 | C29 | C30 | H301 | 180.0° | 180.0° |
C28 | C29 | C30 | H302 | 54.7° | 60.1° |
C28 | C29 | C30 | H303 | 54.7° | 59.9° |
C28 | C29 | C31 | H311 | 180.0° | 65.5° |
C28 | C29 | C31 | H312 | 54.7° | 54.6° |
C28 | C29 | C31 | H313 | 54.8° | 174.6° |
H281 | C28 | C29 | C30 | 34.7° | 53.2° |
H281 | C28 | C29 | C31 | 162.0° | 173.1° |
H281 | C28 | C29 | H29 | 80.6° | 67.0° |
H282 | C28 | C29 | C30 | 74.9° | 66.8° |
H282 | C28 | C29 | C31 | 52.4° | 53.2° |
H282 | C28 | C29 | H29 | 169.9° | 173.1° |
C30 | C29 | C31 | H29 | 114.9° | 120.0° |
C29 | C30 | H301 | H302 | 125.2° | 119.9° |
C29 | C30 | H301 | H303 | 125.3° | 120.1° |
C29 | C30 | H302 | H303 | 117.4° | 120.0° |
C30 | C29 | C31 | H311 | 54.7° | 54.5° |
C30 | C29 | C31 | H312 | 70.6° | 174.5° |
C30 | C29 | C31 | H313 | 179.9° | 65.4° |
C31 | C29 | C30 | H301 | 56.3° | 60.1° |
C31 | C29 | C30 | H302 | 178.5° | 180.0° |
C31 | C29 | C30 | H303 | 69.1° | 60.0° |
C29 | C31 | H311 | H312 | 125.2° | 120.0° |
C29 | C31 | H311 | H313 | 125.2° | 120.0° |
C29 | C31 | H312 | H313 | 118.5° | 120.0° |
H29 | C29 | C30 | H301 | 60.5° | 59.9° |
H29 | C29 | C30 | H302 | 64.7° | 60.0° |
H29 | C29 | C30 | H303 | 174.1° | 180.0° |
H29 | C29 | C31 | H311 | 60.3° | 174.5° |
H29 | C29 | C31 | H312 | 174.4° | 65.4° |
H29 | C29 | C31 | H313 | 65.0° | 54.6° |
H301 | C30 | H302 | H303 | 117.4° | 120.0° |
H311 | C31 | H312 | H313 | 118.6° | 119.9° |
C33 | C32 | O34 | H32 | 119.2° | 120.0° |
C32 | C33 | C35 | H331 | 125.3° | 120.0° |
C32 | C33 | C35 | H332 | 125.2° | 120.0° |
C32 | C33 | H331 | H332 | 115.8° | 120.0° |
C33 | C32 | O34 | HOY | 55.9° | 60.0° |
C32 | C33 | C35 | O36 | 80.3° | 0.0° |
C32 | C33 | C35 | N37 | 97.8° | 180.0° |
O34 | C32 | C33 | C35 | 166.8° | 60.0° |
O34 | C32 | C33 | H331 | 41.5° | 180.0° |
O34 | C32 | C33 | H332 | 67.9° | 60.0° |
H32 | C32 | C33 | C35 | 46.3° | 60.0° |
H32 | C32 | C33 | H331 | 79.0° | 60.0° |
H32 | C32 | C33 | H332 | 171.5° | 180.0° |
H32 | C32 | O34 | HOY | 63.3° | 180.0° |
C35 | C33 | H331 | H332 | 115.9° | 120.0° |
C33 | C35 | O36 | N37 | 177.9° | 180.0° |
C33 | C35 | N37 | C38 | 175.6° | 180.0° |
C33 | C35 | N37 | HN7 | 4.4° | 0.0° |
H331 | C33 | C35 | O36 | 154.4° | 120.0° |
H331 | C33 | C35 | N37 | 27.4° | 60.0° |
H332 | C33 | C35 | O36 | 45.0° | 120.0° |
H332 | C33 | C35 | N37 | 136.9° | 60.0° |
O36 | C35 | N37 | C38 | 2.6° | 0.0° |
O36 | C35 | N37 | HN7 | 177.4° | 180.0° |
C35 | N37 | C38 | HN7 | 180.0° | 180.0° |
C35 | N37 | C38 | C39 | 92.3° | 90.0° |
C35 | N37 | C38 | C41 | 148.2° | 150.0° |
C35 | N37 | C38 | H38 | 29.0° | 30.0° |
N37 | C38 | C39 | C41 | 120.2° | 120.0° |
N37 | C38 | C39 | H38 | 120.6° | 120.0° |
N37 | C38 | C41 | H38 | 120.6° | 120.0° |
N37 | C38 | C39 | C40 | 173.6° | 60.0° |
N37 | C38 | C39 | H391 | 48.3° | 180.0° |
N37 | C38 | C39 | H392 | 61.1° | 60.0° |
N37 | C38 | C41 | O42 | 45.6° | 0.1° |
N37 | C38 | C41 | N43 | 131.4° | 180.0° |
HN7 | N37 | C38 | C39 | 87.7° | 90.0° |
HN7 | N37 | C38 | C41 | 31.8° | 30.0° |
HN7 | N37 | C38 | H38 | 151.0° | 150.0° |
C39 | C38 | C41 | H38 | 121.4° | 120.0° |
C38 | C39 | C40 | H391 | 125.3° | 120.0° |
C38 | C39 | C40 | H392 | 125.3° | 120.0° |
C38 | C39 | H391 | H392 | 114.8° | 119.9° |
C38 | C39 | C40 | H401 | 180.0° | 180.0° |
C38 | C39 | C40 | H402 | 54.8° | 60.0° |
C38 | C39 | C40 | H403 | 54.7° | 60.0° |
C39 | C38 | C41 | O42 | 72.5° | 119.9° |
C39 | C38 | C41 | N43 | 110.6° | 60.0° |
C41 | C38 | C39 | C40 | 66.1° | 180.0° |
C41 | C38 | C39 | H391 | 168.6° | 60.0° |
C41 | C38 | C39 | H392 | 59.1° | 60.0° |
C38 | C41 | O42 | N43 | 176.7° | 179.9° |
C38 | C41 | N43 | C44 | 178.9° | 180.0° |
C38 | C41 | N43 | HN3 | 1.0° | 0.0° |
H38 | C38 | C39 | C40 | 53.0° | 60.0° |
H38 | C38 | C39 | H391 | 72.2° | 60.0° |
H38 | C38 | C39 | H392 | 178.3° | 180.0° |
H38 | C38 | C41 | O42 | 166.2° | 120.1° |
H38 | C38 | C41 | N43 | 10.7° | 60.0° |
C40 | C39 | H391 | H392 | 114.8° | 120.0° |
C39 | C40 | H401 | H402 | 125.2° | 120.0° |
C39 | C40 | H401 | H403 | 125.2° | 120.0° |
C39 | C40 | H402 | H403 | 114.8° | 120.0° |
H391 | C39 | C40 | H401 | 54.8° | 60.0° |
H391 | C39 | C40 | H402 | 180.0° | 59.9° |
H391 | C39 | C40 | H403 | 70.5° | 179.9° |
H392 | C39 | C40 | H401 | 54.7° | 60.0° |
H392 | C39 | C40 | H402 | 70.5° | 180.0° |
H392 | C39 | C40 | H403 | 180.0° | 60.0° |
H401 | C40 | H402 | H403 | 114.9° | 120.0° |
O42 | C41 | N43 | C44 | 2.2° | 0.1° |
O42 | C41 | N43 | HN3 | 177.8° | 179.9° |
C41 | N43 | C44 | HN3 | 180.0° | 180.0° |
C41 | N43 | C44 | C45 | 102.9° | 150.0° |
C41 | N43 | C44 | C56 | 124.3° | 90.0° |
C41 | N43 | C44 | H44 | 9.1° | 30.0° |
N43 | C44 | C45 | C56 | 133.0° | 120.0° |
N43 | C44 | C45 | H44 | 111.6° | 120.0° |
N43 | C44 | C56 | H44 | 112.5° | 119.9° |
N43 | C44 | C45 | C46 | 27.6° | 60.0° |
N43 | C44 | C45 | H451 | 152.9° | 60.0° |
N43 | C44 | C45 | H452 | 97.6° | 179.9° |
N43 | C44 | C56 | O57 | 31.6° | 150.0° |
N43 | C44 | C56 | N58 | 149.8° | 30.0° |
HN3 | N43 | C44 | C45 | 77.0° | 30.1° |
HN3 | N43 | C44 | C56 | 55.7° | 90.0° |
HN3 | N43 | C44 | H44 | 170.9° | 150.0° |
C45 | C44 | C56 | H44 | 113.1° | 120.0° |
C44 | C45 | C46 | H451 | 125.3° | 120.0° |
C44 | C45 | C46 | H452 | 125.2° | 120.1° |
C44 | C45 | H451 | H452 | 117.1° | 120.0° |
C44 | C45 | C46 | C47 | 94.0° | 90.0° |
C44 | C45 | C46 | C50 | 83.1° | 90.3° |
C45 | C44 | C56 | O57 | 102.8° | 90.0° |
C45 | C44 | C56 | N58 | 75.8° | 90.0° |
C56 | C44 | C45 | C46 | 105.4° | 180.0° |
C56 | C44 | C45 | H451 | 19.9° | 60.0° |
C56 | C44 | C45 | H452 | 129.4° | 59.9° |
C44 | C56 | O57 | N58 | 178.6° | 180.0° |
C44 | C56 | N58 | HN1 | 1.4° | 180.0° |
C44 | C56 | N58 | HN2 | 180.0° | 0.0° |
H44 | C44 | C45 | C46 | 139.2° | 60.0° |
H44 | C44 | C45 | H451 | 95.5° | 180.0° |
H44 | C44 | C45 | H452 | 14.0° | 60.1° |
H44 | C44 | C56 | O57 | 144.1° | 30.0° |
H44 | C44 | C56 | N58 | 37.3° | 150.0° |
C46 | C45 | H451 | H452 | 117.1° | 120.0° |
C45 | C46 | C47 | C50 | 177.1° | 179.7° |
C45 | C46 | C47 | C48 | 178.8° | 180.0° |
C45 | C46 | C47 | H47 | 1.2° | 0.1° |
C45 | C46 | C50 | C51 | 178.4° | 179.8° |
C45 | C46 | C50 | C52 | 1.6° | 0.6° |
H451 | C45 | C46 | C47 | 31.3° | 30.0° |
H451 | C45 | C46 | C50 | 151.7° | 149.7° |
H452 | C45 | C46 | C47 | 140.8° | 149.9° |
H452 | C45 | C46 | C50 | 42.2° | 29.8° |
C46 | C47 | C48 | H47 | 180.0° | 179.9° |
C46 | C47 | C48 | C49 | 1.4° | 0.1° |
C46 | C47 | C48 | H48 | 178.7° | 180.0° |
C47 | C46 | C50 | C51 | 1.4° | 0.5° |
C47 | C46 | C50 | C52 | 178.7° | 179.8° |
C50 | C46 | C47 | C48 | 1.7° | 0.3° |
C50 | C46 | C47 | H47 | 178.3° | 179.8° |
C46 | C50 | C51 | C49 | 0.7° | 0.4° |
C46 | C50 | C51 | C52 | 180.0° | 179.3° |
C46 | C50 | C51 | C53 | 179.5° | 179.7° |
C46 | C50 | C52 | C54 | 179.2° | 179.7° |
C46 | C50 | C52 | H52 | 0.8° | 0.5° |
C47 | C48 | C49 | H48 | 180.0° | 180.0° |
C47 | C48 | C49 | C51 | 0.7° | 0.0° |
C47 | C48 | C49 | H49 | 179.3° | 180.0° |
H47 | C47 | C48 | C49 | 178.6° | 180.0° |
H47 | C47 | C48 | H48 | 1.3° | 0.0° |
C48 | C49 | C51 | H49 | 180.0° | 180.0° |
C48 | C49 | C51 | C50 | 0.3° | 0.2° |
C48 | C49 | C51 | C53 | 179.1° | 180.0° |
H48 | C48 | C49 | C51 | 179.4° | 180.0° |
H48 | C48 | C49 | H49 | 0.7° | 0.0° |
C49 | C51 | C50 | C53 | 178.8° | 179.8° |
C49 | C51 | C50 | C52 | 179.3° | 179.7° |
C49 | C51 | C53 | C55 | 178.7° | 179.9° |
C49 | C51 | C53 | H53 | 1.3° | 0.0° |
H49 | C49 | C51 | C50 | 179.6° | 179.8° |
H49 | C49 | C51 | C53 | 0.9° | 0.0° |
C51 | C50 | C52 | C54 | 0.8° | 0.4° |
C51 | C50 | C52 | H52 | 179.2° | 179.8° |
C50 | C51 | C53 | C55 | 0.1° | 0.2° |
C50 | C51 | C53 | H53 | 179.9° | 179.8° |
C52 | C50 | C51 | C53 | 0.5° | 0.4° |
C50 | C52 | C54 | H52 | 180.0° | 179.8° |
C50 | C52 | C54 | C55 | 0.5° | 0.2° |
C50 | C52 | C54 | H54 | 179.5° | 179.7° |
C51 | C53 | C55 | H53 | 180.0° | 180.0° |
C51 | C53 | C55 | C54 | 0.5° | 0.0° |
C51 | C53 | C55 | H55 | 179.5° | 180.0° |
C52 | C54 | C55 | C53 | 0.2° | 0.0° |
C52 | C54 | C55 | H54 | 180.0° | 180.0° |
C52 | C54 | C55 | H55 | 179.8° | 180.0° |
H52 | C52 | C54 | C55 | 179.5° | 180.0° |
H52 | C52 | C54 | H54 | 0.5° | 0.1° |
C53 | C55 | C54 | H55 | 180.0° | 180.0° |
C53 | C55 | C54 | H54 | 179.8° | 180.0° |
H53 | C53 | C55 | C54 | 179.6° | 179.9° |
H53 | C53 | C55 | H55 | 0.4° | 0.1° |
H54 | C54 | C55 | H55 | 0.1° | 0.0° |
O57 | C56 | N58 | HN1 | 180.0° | 0.0° |
O57 | C56 | N58 | HN2 | 1.4° | 180.0° |
C56 | N58 | HN1 | HN2 | 178.5° | 180.0° |