KR9
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C39 | C38 | doub | 1.39Å | 1.40Å | Aromatic |
C39 | C40 | sing | 1.38Å | 1.39Å | Aromatic |
C38 | C37 | sing | 1.37Å | 1.39Å | Aromatic |
C40 | C35 | doub | 1.39Å | 1.41Å | Aromatic |
C37 | C36 | doub | 1.40Å | 1.41Å | Aromatic |
F20 | C19 | sing | 1.40Å | 1.36Å | |
O18 | C19 | sing | 1.43Å | 1.39Å | |
O18 | C17 | sing | 1.36Å | 1.41Å | |
C35 | C36 | sing | 1.41Å | 1.37Å | Aromatic |
C35 | N34 | sing | 1.38Å | 1.37Å | Aromatic |
C36 | C32 | sing | 1.47Å | 1.40Å | Aromatic |
C19 | F21 | sing | 1.40Å | 1.36Å | |
C19 | F22 | sing | 1.40Å | 1.35Å | |
C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
C17 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
C16 | C15 | sing | 1.39Å | 1.38Å | Aromatic |
N34 | C33 | sing | 1.37Å | 1.34Å | Aromatic |
C23 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
C32 | C33 | doub | 1.34Å | 1.39Å | Aromatic |
C32 | C31 | sing | 1.51Å | 1.52Å | |
C15 | C14 | sing | 1.48Å | 1.53Å | |
C15 | C25 | doub | 1.40Å | 1.39Å | Aromatic |
C13 | N12 | doub | 1.32Å | 1.34Å | Aromatic |
C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
N12 | C11 | sing | 1.31Å | 1.35Å | Aromatic |
C14 | C09 | doub | 1.42Å | 1.43Å | Aromatic |
C24 | C25 | sing | 1.39Å | 1.41Å | Aromatic |
C11 | C10 | doub | 1.40Å | 1.43Å | Aromatic |
C31 | C04 | sing | 1.53Å | 1.52Å | |
C09 | C10 | sing | 1.42Å | 1.36Å | Aromatic |
C09 | N08 | sing | 1.33Å | 1.37Å | Aromatic |
C25 | O26 | sing | 1.36Å | 1.41Å | |
C10 | C28 | sing | 1.41Å | 1.43Å | Aromatic |
N08 | C07 | doub | 1.32Å | 1.32Å | Aromatic |
C07 | C29 | sing | 1.40Å | 1.39Å | Aromatic |
C07 | C06 | sing | 1.48Å | 1.50Å | |
C28 | C29 | doub | 1.37Å | 1.40Å | Aromatic |
N05 | C06 | sing | 1.35Å | 1.44Å | |
N05 | C04 | sing | 1.46Å | 1.44Å | |
C06 | O30 | doub | 1.22Å | 1.20Å | |
O26 | C27 | sing | 1.43Å | 1.40Å | |
C04 | C03 | sing | 1.51Å | 1.55Å | |
O41 | C03 | doub | 1.21Å | 1.20Å | |
C03 | N02 | sing | 1.35Å | 1.45Å | |
N02 | C01 | sing | 1.47Å | 1.46Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C04 | H041 | sing | 1.09Å | 1.10Å | |
C11 | H111 | sing | 1.08Å | 1.08Å | |
C13 | H131 | sing | 1.08Å | 1.08Å | |
C16 | H161 | sing | 1.08Å | 1.08Å | |
C23 | H231 | sing | 1.08Å | 1.08Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C27 | H272 | sing | 1.09Å | 1.10Å | |
C27 | H273 | sing | 1.09Å | 1.10Å | |
C27 | H271 | sing | 1.09Å | 1.10Å | |
C28 | H281 | sing | 1.08Å | 1.08Å | |
C29 | H291 | sing | 1.08Å | 1.08Å | |
C31 | H311 | sing | 1.09Å | 1.10Å | |
C31 | H312 | sing | 1.09Å | 1.10Å | |
C33 | H331 | sing | 1.08Å | 1.08Å | |
C37 | H371 | sing | 1.08Å | 1.08Å | |
C38 | H381 | sing | 1.08Å | 1.08Å | |
C39 | H391 | sing | 1.08Å | 1.08Å | |
C40 | H401 | sing | 1.08Å | 1.08Å | |
N02 | H021 | sing | 0.97Å | 1.00Å | |
N05 | H051 | sing | 0.97Å | 1.00Å | |
N34 | H341 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C38 | C39 | C40 | 121.0° | 120.7° |
C39 | C38 | C37 | 119.6° | 120.5° |
C39 | C38 | H381 | 120.2° | 119.8° |
C38 | C39 | H391 | 119.5° | 119.7° |
C39 | C40 | C35 | 119.3° | 119.7° |
C40 | C39 | H391 | 119.5° | 119.6° |
C39 | C40 | H401 | 120.4° | 120.1° |
C38 | C37 | C36 | 119.2° | 119.8° |
C38 | C37 | H371 | 120.4° | 120.1° |
C37 | C38 | H381 | 120.2° | 119.7° |
C40 | C35 | C36 | 119.8° | 119.4° |
C40 | C35 | N34 | 132.2° | 133.5° |
C35 | C40 | H401 | 120.3° | 120.1° |
C37 | C36 | C35 | 121.0° | 119.9° |
C37 | C36 | C32 | 132.0° | 134.0° |
C36 | C37 | H371 | 120.4° | 120.1° |
F20 | C19 | O18 | 110.4° | 109.5° |
F20 | C19 | F21 | 107.4° | 109.5° |
F20 | C19 | F22 | 110.9° | 109.5° |
C19 | O18 | C17 | 114.5° | 117.0° |
O18 | C19 | F21 | 112.7° | 109.5° |
O18 | C19 | F22 | 107.3° | 109.5° |
O18 | C17 | C16 | 117.8° | 119.9° |
O18 | C17 | C23 | 122.7° | 119.9° |
C36 | C35 | N34 | 108.0° | 107.1° |
C35 | C36 | C32 | 106.9° | 106.1° |
C35 | N34 | C33 | 110.3° | 109.8° |
C35 | N34 | H341 | 124.8° | 125.1° |
C36 | C32 | C33 | 107.8° | 106.9° |
C36 | C32 | C31 | 120.9° | 126.5° |
F21 | C19 | F22 | 108.1° | 109.5° |
C16 | C17 | C23 | 119.5° | 120.1° |
C17 | C16 | C15 | 120.8° | 119.9° |
C17 | C16 | H161 | 119.6° | 120.0° |
C17 | C23 | C24 | 119.7° | 120.3° |
C17 | C23 | H231 | 120.2° | 119.8° |
C16 | C15 | C14 | 121.1° | 120.2° |
C16 | C15 | C25 | 120.7° | 119.7° |
C15 | C16 | H161 | 119.6° | 120.1° |
N34 | C33 | C32 | 106.9° | 110.0° |
N34 | C33 | H331 | 126.5° | 125.0° |
C33 | N34 | H341 | 124.9° | 125.1° |
C23 | C24 | C25 | 120.2° | 120.2° |
C24 | C23 | H231 | 120.1° | 119.9° |
C23 | C24 | H241 | 119.9° | 119.9° |
C33 | C32 | C31 | 131.3° | 126.5° |
C32 | C33 | H331 | 126.5° | 125.0° |
C32 | C31 | C04 | 109.9° | 109.5° |
C32 | C31 | H311 | 109.4° | 109.5° |
C32 | C31 | H312 | 109.4° | 109.5° |
C14 | C15 | C25 | 118.2° | 120.1° |
C15 | C14 | C13 | 115.4° | 120.8° |
C15 | C14 | C09 | 123.9° | 120.8° |
C15 | C25 | C24 | 119.1° | 119.8° |
C15 | C25 | O26 | 117.5° | 120.1° |
N12 | C13 | C14 | 120.1° | 121.6° |
C13 | N12 | C11 | 121.6° | 122.9° |
N12 | C13 | H131 | 120.0° | 119.2° |
C13 | C14 | C09 | 120.6° | 118.5° |
C14 | C13 | H131 | 119.9° | 119.2° |
N12 | C11 | C10 | 120.0° | 120.3° |
N12 | C11 | H111 | 120.0° | 119.9° |
C14 | C09 | C10 | 117.7° | 117.8° |
C14 | C09 | N08 | 121.7° | 121.9° |
C24 | C25 | O26 | 123.4° | 120.1° |
C25 | C24 | H241 | 119.9° | 119.9° |
C11 | C10 | C09 | 119.8° | 119.0° |
C11 | C10 | C28 | 119.0° | 121.9° |
C10 | C11 | H111 | 120.0° | 119.9° |
C31 | C04 | N05 | 112.9° | 109.5° |
C31 | C04 | C03 | 108.7° | 109.5° |
C31 | C04 | H041 | 110.1° | 109.4° |
C04 | C31 | H311 | 109.3° | 109.4° |
C04 | C31 | H312 | 109.3° | 109.5° |
C10 | C09 | N08 | 120.4° | 120.2° |
C09 | C10 | C28 | 121.1° | 119.1° |
C09 | N08 | C07 | 119.6° | 121.2° |
C25 | O26 | C27 | 114.8° | 117.0° |
C10 | C28 | C29 | 116.5° | 118.1° |
C10 | C28 | H281 | 121.7° | 121.0° |
N08 | C07 | C29 | 123.0° | 121.5° |
N08 | C07 | C06 | 117.5° | 119.2° |
C29 | C07 | C06 | 118.7° | 119.3° |
C07 | C29 | C28 | 119.2° | 119.9° |
C07 | C29 | H291 | 120.4° | 120.0° |
C07 | C06 | N05 | 115.2° | 120.0° |
C07 | C06 | O30 | 121.3° | 120.0° |
C29 | C28 | H281 | 121.8° | 120.9° |
C28 | C29 | H291 | 120.4° | 120.1° |
C06 | N05 | C04 | 118.3° | 120.0° |
N05 | C06 | O30 | 122.6° | 120.0° |
C06 | N05 | H051 | 120.8° | 120.0° |
N05 | C04 | C03 | 104.1° | 109.5° |
N05 | C04 | H041 | 111.3° | 109.5° |
C04 | N05 | H051 | 120.9° | 120.0° |
O26 | C27 | H272 | 109.5° | 109.5° |
O26 | C27 | H273 | 109.5° | 109.5° |
O26 | C27 | H271 | 109.5° | 109.5° |
C04 | C03 | O41 | 120.2° | 120.0° |
C04 | C03 | N02 | 125.4° | 120.0° |
C03 | C04 | H041 | 109.6° | 109.5° |
O41 | C03 | N02 | 114.3° | 120.0° |
C03 | N02 | C01 | 116.9° | 120.0° |
C03 | N02 | H021 | 121.5° | 120.0° |
N02 | C01 | H011 | 109.5° | 109.5° |
N02 | C01 | H013 | 109.5° | 109.5° |
N02 | C01 | H012 | 109.5° | 109.5° |
C01 | N02 | H021 | 121.5° | 120.0° |
H011 | C01 | H013 | 109.4° | 109.5° |
H011 | C01 | H012 | 109.4° | 109.4° |
H013 | C01 | H012 | 109.5° | 109.5° |
H272 | C27 | H273 | 109.5° | 109.5° |
H272 | C27 | H271 | 109.4° | 109.5° |
H273 | C27 | H271 | 109.5° | 109.4° |
H311 | C31 | H312 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C38 | C39 | C40 | H391 | 180.0° | 180.0° |
C39 | C38 | C37 | H381 | 180.0° | 179.9° |
C38 | C39 | C40 | C35 | 0.5° | 0.0° |
C39 | C38 | C37 | C36 | 1.6° | 0.1° |
C39 | C38 | C37 | H371 | 178.4° | 180.0° |
C38 | C39 | C40 | H401 | 179.5° | 179.9° |
C40 | C39 | C38 | C37 | 1.6° | 0.0° |
C39 | C40 | C35 | H401 | 180.0° | 179.9° |
C39 | C40 | C35 | C36 | 0.7° | 0.0° |
C39 | C40 | C35 | N34 | 179.1° | 179.9° |
C40 | C39 | C38 | H381 | 178.4° | 180.0° |
C38 | C37 | C36 | H371 | 180.0° | 179.9° |
C38 | C37 | C36 | C35 | 0.4° | 0.1° |
C38 | C37 | C36 | C32 | 179.7° | 179.6° |
C37 | C38 | C39 | H391 | 178.3° | 179.9° |
C40 | C35 | C36 | C37 | 0.7° | 0.0° |
C40 | C35 | C36 | N34 | 178.8° | 179.9° |
C40 | C35 | C36 | C32 | 179.2° | 179.7° |
C40 | C35 | N34 | C33 | 179.1° | 179.5° |
C35 | C40 | C39 | H391 | 179.5° | 180.0° |
C40 | C35 | N34 | H341 | 0.9° | 0.1° |
C37 | C36 | C35 | C32 | 179.9° | 179.7° |
C37 | C36 | C35 | N34 | 179.5° | 179.9° |
C37 | C36 | C32 | C33 | 179.7° | 179.6° |
C37 | C36 | C32 | C31 | 0.7° | 0.1° |
C36 | C37 | C38 | H381 | 178.4° | 180.0° |
F20 | C19 | O18 | F21 | 120.1° | 120.0° |
F20 | C19 | O18 | F22 | 121.0° | 120.0° |
F20 | C19 | O18 | C17 | 179.5° | 180.0° |
F20 | C19 | F21 | F22 | 119.8° | 120.0° |
O18 | C19 | F21 | F22 | 118.4° | 120.0° |
C19 | O18 | C17 | C16 | 93.1° | 180.0° |
C19 | O18 | C17 | C23 | 88.2° | 0.1° |
C17 | O18 | C19 | F21 | 60.4° | 59.9° |
C17 | O18 | C19 | F22 | 58.5° | 60.1° |
O18 | C17 | C16 | C23 | 178.8° | 179.9° |
O18 | C17 | C16 | C15 | 179.3° | 180.0° |
O18 | C17 | C23 | C24 | 179.3° | 180.0° |
O18 | C17 | C16 | H161 | 0.7° | 0.1° |
O18 | C17 | C23 | H231 | 0.7° | 0.1° |
C36 | C35 | N34 | C33 | 0.5° | 0.4° |
C35 | C36 | C32 | C33 | 0.2° | 0.0° |
C35 | C36 | C32 | C31 | 179.4° | 179.7° |
C35 | C36 | C37 | H371 | 179.6° | 180.0° |
C36 | C35 | C40 | H401 | 179.3° | 180.0° |
C36 | C35 | N34 | H341 | 179.5° | 180.0° |
N34 | C35 | C36 | C32 | 0.4° | 0.2° |
C35 | N34 | C33 | H341 | 180.0° | 179.6° |
C35 | N34 | C33 | C32 | 0.4° | 0.4° |
C35 | N34 | C33 | H331 | 179.6° | 179.6° |
N34 | C35 | C40 | H401 | 0.9° | 0.1° |
C36 | C32 | C33 | N34 | 0.1° | 0.2° |
C36 | C32 | C33 | C31 | 179.5° | 179.7° |
C36 | C32 | C31 | C04 | 139.7° | 86.7° |
C36 | C32 | C31 | H311 | 100.2° | 33.3° |
C36 | C32 | C31 | H312 | 19.6° | 153.2° |
C36 | C32 | C33 | H331 | 179.8° | 179.7° |
C32 | C36 | C37 | H371 | 0.3° | 0.4° |
C17 | C16 | C15 | H161 | 180.0° | 179.9° |
C16 | C17 | C23 | C24 | 0.6° | 0.1° |
C17 | C16 | C15 | C14 | 179.7° | 180.0° |
C17 | C16 | C15 | C25 | 1.2° | 0.4° |
C16 | C17 | C23 | H231 | 179.5° | 180.0° |
C23 | C17 | C16 | C15 | 0.6° | 0.1° |
C17 | C23 | C24 | H231 | 180.0° | 179.9° |
C17 | C23 | C24 | C25 | 1.2° | 0.4° |
C23 | C17 | C16 | H161 | 179.4° | 180.0° |
C17 | C23 | C24 | H241 | 178.8° | 180.0° |
C16 | C15 | C14 | C25 | 178.6° | 179.7° |
C16 | C15 | C14 | C13 | 125.9° | 65.4° |
C16 | C15 | C14 | C09 | 57.1° | 113.9° |
C16 | C15 | C25 | C24 | 1.8° | 0.6° |
C16 | C15 | C25 | O26 | 179.5° | 179.7° |
N34 | C33 | C32 | H331 | 180.0° | 179.9° |
N34 | C33 | C32 | C31 | 179.6° | 179.9° |
C23 | C24 | C25 | C15 | 1.8° | 0.6° |
C23 | C24 | C25 | H241 | 180.0° | 179.7° |
C23 | C24 | C25 | O26 | 179.6° | 179.7° |
C33 | C32 | C31 | C04 | 39.7° | 93.0° |
C33 | C32 | C31 | H311 | 80.3° | 147.0° |
C33 | C32 | C31 | H312 | 159.8° | 27.1° |
C32 | C33 | N34 | H341 | 179.6° | 180.0° |
C32 | C31 | C04 | H311 | 120.1° | 120.0° |
C32 | C31 | C04 | H312 | 120.1° | 120.1° |
C32 | C31 | C04 | N05 | 85.1° | 63.4° |
C32 | C31 | C04 | C03 | 159.9° | 176.6° |
C32 | C31 | C04 | H041 | 39.9° | 56.6° |
C32 | C31 | H311 | H312 | 119.8° | 120.0° |
C31 | C32 | C33 | H331 | 0.4° | 0.0° |
C15 | C14 | C13 | N12 | 179.8° | 180.0° |
C15 | C14 | C13 | C09 | 177.1° | 179.3° |
C14 | C15 | C25 | C24 | 179.7° | 179.7° |
C15 | C14 | C09 | C10 | 179.0° | 179.4° |
C15 | C14 | C09 | N08 | 3.5° | 0.4° |
C14 | C15 | C25 | O26 | 1.0° | 0.0° |
C15 | C14 | C13 | H131 | 0.2° | 1.0° |
C14 | C15 | C16 | H161 | 0.3° | 0.1° |
C25 | C15 | C14 | C13 | 52.7° | 114.9° |
C25 | C15 | C14 | C09 | 124.3° | 65.7° |
C15 | C25 | C24 | O26 | 178.6° | 179.7° |
C15 | C25 | O26 | C27 | 175.2° | 175.2° |
C25 | C15 | C16 | H161 | 178.8° | 179.8° |
C15 | C25 | C24 | H241 | 178.2° | 179.7° |
N12 | C13 | C14 | H131 | 180.0° | 179.0° |
N12 | C13 | C14 | C09 | 2.7° | 0.6° |
C13 | N12 | C11 | C10 | 1.8° | 0.6° |
C13 | N12 | C11 | H111 | 178.2° | 179.4° |
C14 | C13 | N12 | C11 | 1.5° | 0.9° |
C13 | C14 | C09 | C10 | 4.2° | 0.1° |
C13 | C14 | C09 | N08 | 179.7° | 179.7° |
N12 | C11 | C10 | H111 | 180.0° | 180.0° |
N12 | C11 | C10 | C09 | 3.4° | 0.0° |
N12 | C11 | C10 | C28 | 179.6° | 179.7° |
C11 | N12 | C13 | H131 | 178.5° | 179.9° |
C14 | C09 | C10 | C11 | 4.5° | 0.2° |
C14 | C09 | C10 | N08 | 175.5° | 179.8° |
C14 | C09 | C10 | C28 | 178.6° | 180.0° |
C14 | C09 | N08 | C07 | 175.3° | 179.8° |
C09 | C14 | C13 | H131 | 177.3° | 179.7° |
C24 | C25 | O26 | C27 | 6.1° | 5.1° |
C25 | C24 | C23 | H231 | 178.8° | 179.7° |
C11 | C10 | C09 | C28 | 176.9° | 179.7° |
C11 | C10 | C09 | N08 | 180.0° | 180.0° |
C11 | C10 | C28 | C29 | 179.1° | 179.8° |
C11 | C10 | C28 | H281 | 0.9° | 0.3° |
C31 | C04 | N05 | C06 | 119.9° | 157.4° |
C31 | C04 | N05 | C03 | 117.7° | 120.0° |
C31 | C04 | N05 | H041 | 124.4° | 119.9° |
C31 | C04 | C03 | H041 | 120.3° | 119.9° |
C31 | C04 | C03 | O41 | 85.7° | 120.1° |
C31 | C04 | C03 | N02 | 91.9° | 60.0° |
C04 | C31 | H311 | H312 | 119.8° | 120.0° |
C31 | C04 | N05 | H051 | 60.1° | 22.7° |
C10 | C09 | N08 | C07 | 0.0° | 0.0° |
C09 | C10 | C28 | C29 | 2.2° | 0.5° |
C09 | C10 | C11 | H111 | 176.5° | 180.0° |
C09 | C10 | C28 | H281 | 177.8° | 180.0° |
N08 | C09 | C10 | C28 | 3.1° | 0.2° |
C09 | N08 | C07 | C29 | 4.0° | 0.0° |
C09 | N08 | C07 | C06 | 173.8° | 179.7° |
O26 | C25 | C24 | H241 | 0.4° | 0.0° |
C25 | O26 | C27 | H272 | 180.0° | 175.8° |
C25 | O26 | C27 | H273 | 60.0° | 55.8° |
C25 | O26 | C27 | H271 | 60.0° | 64.2° |
C10 | C28 | C29 | C07 | 1.6° | 0.5° |
C10 | C28 | C29 | H281 | 180.0° | 179.5° |
C28 | C10 | C11 | H111 | 0.4° | 0.3° |
C10 | C28 | C29 | H291 | 178.4° | 179.5° |
N08 | C07 | C29 | C06 | 169.6° | 179.8° |
N08 | C07 | C29 | C28 | 4.8° | 0.2° |
N08 | C07 | C06 | N05 | 8.2° | 175.2° |
N08 | C07 | C06 | O30 | 161.7° | 4.9° |
N08 | C07 | C29 | H291 | 175.2° | 179.8° |
C07 | C29 | C28 | H291 | 180.0° | 180.0° |
C29 | C07 | C06 | N05 | 178.4° | 5.0° |
C29 | C07 | C06 | O30 | 8.5° | 174.9° |
C07 | C29 | C28 | H281 | 178.4° | 180.0° |
C06 | C07 | C29 | C28 | 174.4° | 180.0° |
C07 | C06 | N05 | O30 | 169.8° | 179.9° |
C07 | C06 | N05 | C04 | 172.5° | 174.6° |
C06 | C07 | C29 | H291 | 5.5° | 0.0° |
C07 | C06 | N05 | H051 | 7.5° | 5.3° |
C06 | N05 | C04 | H051 | 180.0° | 179.9° |
C06 | N05 | C04 | C03 | 122.4° | 82.6° |
C06 | N05 | C04 | H041 | 4.5° | 37.5° |
C04 | N05 | C06 | O30 | 2.7° | 5.5° |
N05 | C04 | C03 | H041 | 119.1° | 120.0° |
N05 | C04 | C03 | O41 | 34.9° | 0.1° |
N05 | C04 | C03 | N02 | 147.5° | 180.0° |
N05 | C04 | C31 | H311 | 154.8° | 56.6° |
N05 | C04 | C31 | H312 | 34.9° | 176.5° |
O30 | C06 | N05 | H051 | 177.3° | 174.7° |
O26 | C27 | H272 | H273 | 120.0° | 120.0° |
O26 | C27 | H272 | H271 | 120.0° | 120.0° |
O26 | C27 | H273 | H271 | 120.0° | 120.0° |
C04 | C03 | O41 | N02 | 177.8° | 179.9° |
C04 | C03 | N02 | C01 | 176.9° | 180.0° |
C03 | C04 | C31 | H311 | 39.8° | 63.5° |
C03 | C04 | C31 | H312 | 80.0° | 56.5° |
C04 | C03 | N02 | H021 | 3.1° | 0.0° |
C03 | C04 | N05 | H051 | 57.6° | 97.3° |
O41 | C03 | N02 | C01 | 0.8° | 0.0° |
O41 | C03 | C04 | H041 | 154.0° | 120.0° |
O41 | C03 | N02 | H021 | 179.2° | 180.0° |
C03 | N02 | C01 | H021 | 180.0° | 180.0° |
C03 | N02 | C01 | H011 | 180.0° | 180.0° |
C03 | N02 | C01 | H013 | 60.0° | 60.0° |
C03 | N02 | C01 | H012 | 60.0° | 60.0° |
N02 | C03 | C04 | H041 | 28.4° | 60.0° |
N02 | C01 | H011 | H013 | 120.0° | 120.0° |
N02 | C01 | H011 | H012 | 120.0° | 120.0° |
N02 | C01 | H013 | H012 | 120.0° | 120.0° |
H011 | C01 | H013 | H012 | 120.0° | 120.0° |
H011 | C01 | N02 | H021 | 0.0° | 0.0° |
H013 | C01 | N02 | H021 | 120.0° | 120.0° |
H012 | C01 | N02 | H021 | 120.0° | 120.0° |
H041 | C04 | C31 | H311 | 80.2° | 176.6° |
H041 | C04 | C31 | H312 | 159.9° | 63.5° |
H041 | C04 | N05 | H051 | 175.5° | 142.7° |
H231 | C23 | C24 | H241 | 1.2° | 0.1° |
H272 | C27 | H273 | H271 | 120.0° | 120.0° |
H281 | C28 | C29 | H291 | 1.6° | 0.1° |
H331 | C33 | N34 | H341 | 0.4° | 0.1° |
H371 | C37 | C38 | H381 | 1.6° | 0.1° |
H381 | C38 | C39 | H391 | 1.7° | 0.0° |
H391 | C39 | C40 | H401 | 0.5° | 0.1° |