N1V
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
C23 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
C24 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
C22 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
C25 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
C21 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
C20 | C19 | sing | 1.48Å | 1.51Å | |
C01 | C02 | doub | 1.33Å | 1.34Å | |
C19 | C09 | sing | 1.51Å | 1.54Å | |
C19 | C12 | doub | 1.32Å | 1.38Å | |
C02 | C09 | sing | 1.51Å | 1.56Å | |
C02 | C03 | sing | 1.48Å | 1.52Å | |
C13 | C12 | sing | 1.51Å | 1.53Å | |
C13 | C14 | sing | 1.53Å | 1.56Å | |
C33 | C09 | sing | 1.54Å | 1.54Å | |
C33 | C32 | sing | 1.54Å | 1.52Å | |
C08 | C03 | doub | 1.40Å | 1.41Å | Aromatic |
C08 | C07 | sing | 1.38Å | 1.40Å | Aromatic |
C09 | C10 | sing | 1.55Å | 1.58Å | |
C15 | C16 | sing | 1.53Å | 1.55Å | |
C15 | C14 | sing | 1.53Å | 1.56Å | |
C12 | C11 | sing | 1.51Å | 1.50Å | |
C03 | C04 | sing | 1.40Å | 1.41Å | Aromatic |
C17 | C16 | sing | 1.53Å | 1.56Å | |
C17 | C18 | sing | 1.53Å | 1.53Å | |
C07 | C06 | doub | 1.38Å | 1.39Å | Aromatic |
C04 | C05 | doub | 1.38Å | 1.40Å | Aromatic |
C32 | C26 | sing | 1.53Å | 1.53Å | |
C06 | C05 | sing | 1.38Å | 1.39Å | Aromatic |
C10 | C11 | sing | 1.55Å | 1.53Å | |
C10 | C26 | sing | 1.54Å | 1.57Å | |
C26 | O27 | sing | 1.43Å | 1.40Å | |
O27 | S28 | sing | 1.52Å | 1.62Å | |
S28 | O31 | doub | 1.42Å | 1.41Å | |
S28 | N30 | sing | 1.66Å | 1.63Å | |
S28 | O29 | doub | 1.42Å | 1.40Å | |
C25 | H251 | sing | 1.08Å | 1.08Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C26 | H261 | sing | 1.09Å | 1.10Å | |
C23 | H231 | sing | 1.08Å | 1.08Å | |
C22 | H221 | sing | 1.08Å | 1.08Å | |
C21 | H211 | sing | 1.08Å | 1.08Å | |
C18 | H183 | sing | 1.09Å | 1.10Å | |
C18 | H181 | sing | 1.09Å | 1.10Å | |
C18 | H182 | sing | 1.09Å | 1.10Å | |
C17 | H172 | sing | 1.09Å | 1.10Å | |
C17 | H171 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C15 | H151 | sing | 1.09Å | 1.10Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C13 | H131 | sing | 1.09Å | 1.10Å | |
C13 | H132 | sing | 1.09Å | 1.10Å | |
C14 | H142 | sing | 1.09Å | 1.10Å | |
C14 | H141 | sing | 1.09Å | 1.10Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C01 | H012 | sing | 1.08Å | 1.08Å | |
C01 | H011 | sing | 1.08Å | 1.08Å | |
C04 | H041 | sing | 1.08Å | 1.08Å | |
C05 | H051 | sing | 1.08Å | 1.08Å | |
C06 | H061 | sing | 1.08Å | 1.08Å | |
C07 | H071 | sing | 1.08Å | 1.08Å | |
C08 | H081 | sing | 1.08Å | 1.08Å | |
C32 | H322 | sing | 1.09Å | 1.10Å | |
C32 | H321 | sing | 1.09Å | 1.10Å | |
C33 | H331 | sing | 1.09Å | 1.10Å | |
C33 | H332 | sing | 1.09Å | 1.10Å | |
N30 | H301 | sing | 0.97Å | 1.00Å | |
N30 | H302 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C24 | C23 | C22 | 116.6° | 120.3° |
C23 | C24 | C25 | 121.3° | 120.1° |
C23 | C24 | H241 | 119.4° | 119.9° |
C24 | C23 | H231 | 121.7° | 119.8° |
C23 | C22 | C21 | 121.9° | 120.1° |
C22 | C23 | H231 | 121.7° | 119.9° |
C23 | C22 | H221 | 119.1° | 120.0° |
C24 | C25 | C20 | 122.9° | 119.8° |
C24 | C25 | H251 | 118.5° | 120.1° |
C25 | C24 | H241 | 119.4° | 119.9° |
C22 | C21 | C20 | 121.8° | 119.9° |
C21 | C22 | H221 | 119.1° | 119.9° |
C22 | C21 | H211 | 119.1° | 120.1° |
C25 | C20 | C21 | 115.5° | 119.7° |
C25 | C20 | C19 | 122.2° | 120.1° |
C20 | C25 | H251 | 118.6° | 120.1° |
C21 | C20 | C19 | 122.3° | 120.1° |
C20 | C21 | H211 | 119.1° | 120.1° |
C20 | C19 | C09 | 121.7° | 124.6° |
C20 | C19 | C12 | 124.9° | 124.6° |
C01 | C02 | C09 | 118.5° | 120.0° |
C01 | C02 | C03 | 118.0° | 120.0° |
C02 | C01 | H012 | 120.0° | 120.0° |
C02 | C01 | H011 | 120.0° | 120.0° |
C09 | C19 | C12 | 111.6° | 110.9° |
C19 | C09 | C02 | 113.9° | 111.9° |
C19 | C09 | C33 | 114.3° | 110.1° |
C19 | C09 | C10 | 102.3° | 104.7° |
C19 | C12 | C13 | 131.7° | 124.6° |
C19 | C12 | C11 | 111.3° | 110.8° |
C09 | C02 | C03 | 123.5° | 120.0° |
C02 | C09 | C33 | 112.8° | 112.7° |
C02 | C09 | C10 | 110.0° | 112.1° |
C02 | C03 | C08 | 122.8° | 120.1° |
C02 | C03 | C04 | 123.2° | 120.2° |
C12 | C13 | C14 | 118.5° | 109.5° |
C13 | C12 | C11 | 116.5° | 124.5° |
C12 | C13 | H131 | 107.2° | 109.5° |
C12 | C13 | H132 | 107.2° | 109.4° |
C13 | C14 | C15 | 116.1° | 109.4° |
C14 | C13 | H131 | 107.2° | 109.5° |
C14 | C13 | H132 | 107.2° | 109.4° |
C13 | C14 | H142 | 107.8° | 109.5° |
C13 | C14 | H141 | 107.8° | 109.5° |
C09 | C33 | C32 | 107.4° | 106.2° |
C33 | C09 | C10 | 102.2° | 104.9° |
C09 | C33 | H331 | 110.0° | 110.1° |
C09 | C33 | H332 | 110.0° | 110.1° |
C33 | C32 | C26 | 104.8° | 107.1° |
C33 | C32 | H322 | 110.6° | 110.0° |
C33 | C32 | H321 | 110.6° | 110.1° |
C32 | C33 | H331 | 110.0° | 110.1° |
C32 | C33 | H332 | 110.0° | 110.1° |
C03 | C08 | C07 | 123.5° | 119.9° |
C08 | C03 | C04 | 114.0° | 119.7° |
C03 | C08 | H081 | 118.3° | 120.1° |
C08 | C07 | C06 | 120.9° | 120.1° |
C08 | C07 | H071 | 119.5° | 119.9° |
C07 | C08 | H081 | 118.3° | 120.0° |
C09 | C10 | C11 | 107.1° | 101.2° |
C09 | C10 | C26 | 108.9° | 105.6° |
C09 | C10 | H101 | 109.0° | 114.1° |
C16 | C15 | C14 | 116.7° | 109.4° |
C15 | C16 | C17 | 115.7° | 109.5° |
C15 | C16 | H162 | 107.9° | 109.5° |
C15 | C16 | H161 | 107.9° | 109.4° |
C16 | C15 | H151 | 107.6° | 109.5° |
C16 | C15 | H152 | 107.6° | 109.5° |
C14 | C15 | H151 | 107.6° | 109.5° |
C14 | C15 | H152 | 107.6° | 109.5° |
C15 | C14 | H142 | 107.8° | 109.4° |
C15 | C14 | H141 | 107.8° | 109.5° |
C12 | C11 | C10 | 104.4° | 104.8° |
C12 | C11 | H111 | 110.7° | 110.3° |
C12 | C11 | H112 | 110.7° | 110.4° |
C03 | C04 | C05 | 123.0° | 119.9° |
C03 | C04 | H041 | 118.5° | 120.1° |
C16 | C17 | C18 | 115.4° | 109.5° |
C16 | C17 | H172 | 108.0° | 109.5° |
C16 | C17 | H171 | 108.0° | 109.4° |
C17 | C16 | H162 | 107.9° | 109.5° |
C17 | C16 | H161 | 107.9° | 109.4° |
C17 | C18 | H183 | 109.5° | 109.5° |
C17 | C18 | H181 | 109.5° | 109.5° |
C17 | C18 | H182 | 109.5° | 109.5° |
C18 | C17 | H172 | 107.9° | 109.5° |
C18 | C17 | H171 | 107.9° | 109.5° |
C07 | C06 | C05 | 117.2° | 120.3° |
C07 | C06 | H061 | 121.4° | 119.9° |
C06 | C07 | H071 | 119.5° | 119.9° |
C04 | C05 | C06 | 121.3° | 120.1° |
C05 | C04 | H041 | 118.5° | 120.1° |
C04 | C05 | H051 | 119.3° | 119.9° |
C32 | C26 | C10 | 103.1° | 107.5° |
C32 | C26 | O27 | 113.0° | 109.9° |
C32 | C26 | H261 | 107.6° | 109.9° |
C26 | C32 | H322 | 110.6° | 109.9° |
C26 | C32 | H321 | 110.6° | 109.9° |
C06 | C05 | H051 | 119.4° | 120.0° |
C05 | C06 | H061 | 121.4° | 119.8° |
C11 | C10 | C26 | 113.1° | 108.6° |
C10 | C11 | H111 | 110.7° | 110.4° |
C10 | C11 | H112 | 110.8° | 110.5° |
C11 | C10 | H101 | 109.5° | 113.2° |
C10 | C26 | O27 | 116.2° | 109.8° |
C10 | C26 | H261 | 107.1° | 109.8° |
C26 | C10 | H101 | 109.1° | 113.1° |
C26 | O27 | S28 | 128.5° | 114.0° |
O27 | C26 | H261 | 109.3° | 109.9° |
O27 | S28 | O31 | 101.8° | 106.4° |
O27 | S28 | N30 | 104.8° | 107.2° |
O27 | S28 | O29 | 110.0° | 106.4° |
O31 | S28 | N30 | 109.6° | 106.4° |
O31 | S28 | O29 | 119.6° | 123.2° |
N30 | S28 | O29 | 109.9° | 106.4° |
S28 | N30 | H301 | 109.5° | 120.0° |
S28 | N30 | H302 | 109.5° | 120.0° |
H183 | C18 | H181 | 109.5° | 109.5° |
H183 | C18 | H182 | 109.5° | 109.4° |
H181 | C18 | H182 | 109.5° | 109.5° |
H172 | C17 | H171 | 109.5° | 109.5° |
H162 | C16 | H161 | 109.5° | 109.5° |
H151 | C15 | H152 | 109.5° | 109.5° |
H111 | C11 | H112 | 109.5° | 110.3° |
H131 | C13 | H132 | 109.5° | 109.5° |
H142 | C14 | H141 | 109.5° | 109.6° |
H012 | C01 | H011 | 120.0° | 120.0° |
H322 | C32 | H321 | 109.5° | 109.8° |
H331 | C33 | H332 | 109.5° | 110.1° |
H301 | N30 | H302 | 109.5° | 119.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C24 | C23 | C22 | H231 | 180.0° | 179.9° |
C23 | C24 | C25 | H241 | 180.0° | 179.9° |
C24 | C23 | C22 | C21 | 0.0° | 0.0° |
C23 | C24 | C25 | C20 | 0.3° | 0.1° |
C23 | C24 | C25 | H251 | 179.7° | 179.7° |
C24 | C23 | C22 | H221 | 180.0° | 180.0° |
C22 | C23 | C24 | C25 | 0.1° | 0.0° |
C23 | C22 | C21 | H221 | 180.0° | 180.0° |
C23 | C22 | C21 | C20 | 0.5° | 0.0° |
C22 | C23 | C24 | H241 | 179.9° | 180.0° |
C23 | C22 | C21 | H211 | 179.5° | 180.0° |
C24 | C25 | C20 | H251 | 180.0° | 179.6° |
C24 | C25 | C20 | C21 | 0.7° | 0.1° |
C24 | C25 | C20 | C19 | 179.4° | 179.7° |
C25 | C24 | C23 | H231 | 179.9° | 179.9° |
C22 | C21 | C20 | C25 | 0.8° | 0.0° |
C22 | C21 | C20 | H211 | 180.0° | 180.0° |
C22 | C21 | C20 | C19 | 179.5° | 179.8° |
C21 | C22 | C23 | H231 | 180.0° | 180.0° |
C25 | C20 | C21 | C19 | 178.7° | 179.8° |
C25 | C20 | C19 | C09 | 74.4° | 110.0° |
C25 | C20 | C19 | C12 | 122.4° | 70.0° |
C20 | C25 | C24 | H241 | 179.7° | 180.0° |
C25 | C20 | C21 | H211 | 179.2° | 179.9° |
C21 | C20 | C19 | C09 | 104.1° | 69.8° |
C21 | C20 | C19 | C12 | 59.0° | 110.2° |
C21 | C20 | C25 | H251 | 179.3° | 179.7° |
C20 | C21 | C22 | H221 | 179.5° | 180.0° |
C20 | C19 | C09 | C12 | 165.2° | 180.0° |
C20 | C19 | C09 | C02 | 75.0° | 75.5° |
C20 | C19 | C12 | C13 | 10.9° | 0.1° |
C20 | C19 | C09 | C33 | 56.7° | 50.6° |
C20 | C19 | C09 | C10 | 166.4° | 162.9° |
C20 | C19 | C12 | C11 | 177.2° | 179.9° |
C19 | C20 | C25 | H251 | 0.6° | 0.1° |
C19 | C20 | C21 | H211 | 0.5° | 0.2° |
C01 | C02 | C09 | C19 | 105.8° | 114.5° |
C01 | C02 | C09 | C03 | 178.6° | 180.0° |
C01 | C02 | C09 | C33 | 26.6° | 10.1° |
C01 | C02 | C03 | C08 | 125.7° | 108.7° |
C01 | C02 | C09 | C10 | 140.0° | 128.1° |
C01 | C02 | C03 | C04 | 55.4° | 71.6° |
C02 | C01 | H012 | H011 | 180.0° | 179.9° |
C19 | C09 | C02 | C33 | 132.4° | 124.7° |
C19 | C09 | C02 | C10 | 114.2° | 117.3° |
C19 | C09 | C02 | C03 | 72.8° | 65.4° |
C09 | C19 | C12 | C13 | 175.5° | 179.9° |
C19 | C09 | C33 | C10 | 109.7° | 112.2° |
C19 | C09 | C33 | C32 | 83.1° | 83.5° |
C09 | C19 | C12 | C11 | 12.6° | 0.1° |
C19 | C09 | C10 | C11 | 10.1° | 25.7° |
C19 | C09 | C10 | C26 | 112.6° | 87.5° |
C19 | C09 | C10 | H101 | 128.5° | 147.6° |
C19 | C09 | C33 | H331 | 36.6° | 35.7° |
C19 | C09 | C33 | H332 | 157.2° | 157.3° |
C12 | C19 | C09 | C02 | 119.8° | 104.5° |
C19 | C12 | C13 | C11 | 171.6° | 180.0° |
C19 | C12 | C13 | C14 | 126.9° | 95.0° |
C12 | C19 | C09 | C33 | 108.5° | 129.4° |
C12 | C19 | C09 | C10 | 1.2° | 17.1° |
C19 | C12 | C11 | C10 | 18.5° | 17.0° |
C19 | C12 | C11 | H111 | 100.7° | 101.8° |
C19 | C12 | C11 | H112 | 137.7° | 136.1° |
C19 | C12 | C13 | H131 | 5.6° | 145.0° |
C19 | C12 | C13 | H132 | 111.8° | 24.9° |
C02 | C09 | C33 | C10 | 118.1° | 122.1° |
C02 | C09 | C33 | C32 | 144.7° | 150.8° |
C09 | C02 | C03 | C08 | 52.9° | 71.3° |
C09 | C02 | C03 | C04 | 126.1° | 108.4° |
C02 | C09 | C10 | C11 | 111.3° | 95.9° |
C02 | C09 | C10 | C26 | 126.0° | 151.0° |
C02 | C09 | C10 | H101 | 7.1° | 26.1° |
C09 | C02 | C01 | H012 | 178.6° | 174.3° |
C09 | C02 | C01 | H011 | 1.4° | 5.5° |
C02 | C09 | C33 | H331 | 95.6° | 90.0° |
C02 | C09 | C33 | H332 | 25.0° | 31.7° |
C03 | C02 | C09 | C33 | 154.8° | 169.9° |
C02 | C03 | C08 | C04 | 179.0° | 179.7° |
C02 | C03 | C08 | C07 | 179.7° | 179.7° |
C03 | C02 | C09 | C10 | 41.4° | 51.9° |
C02 | C03 | C04 | C05 | 179.7° | 180.0° |
C03 | C02 | C01 | H012 | 0.0° | 5.7° |
C03 | C02 | C01 | H011 | 180.0° | 174.4° |
C02 | C03 | C04 | H041 | 0.3° | 0.1° |
C02 | C03 | C08 | H081 | 0.4° | 0.0° |
C12 | C13 | C14 | H131 | 121.3° | 120.1° |
C12 | C13 | C14 | H132 | 121.3° | 119.9° |
C12 | C13 | C14 | C15 | 58.4° | 180.0° |
C13 | C12 | C11 | C10 | 168.2° | 163.0° |
C13 | C12 | C11 | H111 | 72.6° | 78.2° |
C13 | C12 | C11 | H112 | 49.0° | 44.0° |
C12 | C13 | H131 | H132 | 115.9° | 120.0° |
C12 | C13 | C14 | H142 | 179.4° | 60.1° |
C12 | C13 | C14 | H141 | 62.5° | 60.0° |
C13 | C14 | C15 | C16 | 160.0° | 180.0° |
C13 | C14 | C15 | H142 | 121.0° | 119.9° |
C13 | C14 | C15 | H141 | 120.9° | 120.0° |
C14 | C13 | C12 | C11 | 44.7° | 85.0° |
C13 | C14 | C15 | H151 | 39.0° | 60.0° |
C13 | C14 | C15 | H152 | 79.0° | 60.0° |
C14 | C13 | H131 | H132 | 115.9° | 120.0° |
C13 | C14 | H142 | H141 | 117.0° | 120.1° |
C09 | C33 | C32 | H331 | 119.7° | 119.2° |
C09 | C33 | C32 | H332 | 119.7° | 119.2° |
C09 | C33 | C32 | C26 | 38.4° | 18.0° |
C33 | C09 | C10 | C11 | 128.6° | 141.6° |
C33 | C09 | C10 | C26 | 5.9° | 28.4° |
C33 | C09 | C10 | H101 | 113.0° | 96.5° |
C09 | C33 | C32 | H322 | 80.9° | 137.4° |
C09 | C33 | C32 | H321 | 157.7° | 101.5° |
C09 | C33 | H331 | H332 | 121.0° | 121.7° |
C32 | C33 | C09 | C10 | 26.6° | 28.6° |
C33 | C32 | C26 | H322 | 119.3° | 119.4° |
C33 | C32 | C26 | H321 | 119.3° | 119.6° |
C33 | C32 | C26 | C10 | 32.5° | 0.2° |
C33 | C32 | C26 | O27 | 158.7° | 119.7° |
C33 | C32 | C26 | H261 | 80.5° | 119.4° |
C33 | C32 | H322 | H321 | 122.1° | 121.3° |
C32 | C33 | H331 | H332 | 121.0° | 121.6° |
C03 | C08 | C07 | H081 | 180.0° | 179.6° |
C03 | C08 | C07 | C06 | 0.3° | 0.7° |
C08 | C03 | C04 | C05 | 0.7° | 0.3° |
C08 | C03 | C04 | H041 | 179.3° | 179.8° |
C03 | C08 | C07 | H071 | 179.7° | 179.7° |
C07 | C08 | C03 | C04 | 0.6° | 0.6° |
C08 | C07 | C06 | H071 | 180.0° | 179.6° |
C08 | C07 | C06 | C05 | 0.0° | 0.4° |
C08 | C07 | C06 | H061 | 179.9° | 179.6° |
C09 | C10 | C11 | C12 | 16.9° | 25.6° |
C09 | C10 | C26 | C32 | 16.3° | 17.5° |
C09 | C10 | C11 | C26 | 120.0° | 110.9° |
C09 | C10 | C11 | H101 | 118.1° | 122.6° |
C09 | C10 | C26 | H101 | 118.8° | 125.5° |
C09 | C10 | C26 | O27 | 140.5° | 102.0° |
C09 | C10 | C26 | H261 | 97.0° | 137.1° |
C09 | C10 | C11 | H111 | 102.2° | 93.2° |
C09 | C10 | C11 | H112 | 136.1° | 144.5° |
C10 | C09 | C33 | H331 | 146.3° | 147.8° |
C10 | C09 | C33 | H332 | 93.1° | 90.5° |
C16 | C15 | C14 | H151 | 121.1° | 120.0° |
C16 | C15 | C14 | H152 | 121.0° | 120.0° |
C15 | C16 | C17 | H162 | 120.9° | 120.0° |
C15 | C16 | C17 | H161 | 120.9° | 120.0° |
C15 | C16 | C17 | C18 | 160.6° | 180.0° |
C15 | C16 | C17 | H172 | 39.8° | 60.0° |
C15 | C16 | C17 | H171 | 78.5° | 60.0° |
C15 | C16 | H162 | H161 | 117.1° | 120.0° |
C16 | C15 | H151 | H152 | 116.7° | 120.0° |
C16 | C15 | C14 | H142 | 39.0° | 60.0° |
C16 | C15 | C14 | H141 | 79.1° | 60.0° |
C14 | C15 | C16 | C17 | 161.5° | 180.0° |
C14 | C15 | C16 | H162 | 77.5° | 60.0° |
C14 | C15 | C16 | H161 | 40.6° | 60.0° |
C14 | C15 | H151 | H152 | 116.7° | 120.0° |
C15 | C14 | C13 | H131 | 62.9° | 60.0° |
C15 | C14 | C13 | H132 | 179.7° | 60.1° |
C15 | C14 | H142 | H141 | 117.0° | 120.0° |
C12 | C11 | C10 | H111 | 119.2° | 118.8° |
C12 | C11 | C10 | H112 | 119.2° | 118.9° |
C12 | C11 | C10 | C26 | 103.1° | 85.3° |
C12 | C11 | H111 | H112 | 122.3° | 122.2° |
C11 | C12 | C13 | H131 | 166.0° | 35.0° |
C11 | C12 | C13 | H132 | 76.6° | 155.0° |
C12 | C11 | C10 | H101 | 135.0° | 148.2° |
C03 | C04 | C05 | H041 | 180.0° | 180.0° |
C03 | C04 | C05 | C06 | 0.4° | 0.0° |
C03 | C04 | C05 | H051 | 179.6° | 180.0° |
C04 | C03 | C08 | H081 | 179.4° | 179.7° |
C16 | C17 | C18 | H172 | 120.9° | 120.0° |
C16 | C17 | C18 | H171 | 120.9° | 120.0° |
C16 | C17 | C18 | H183 | 180.0° | 60.0° |
C16 | C17 | C18 | H181 | 60.0° | 180.0° |
C16 | C17 | C18 | H182 | 60.0° | 60.0° |
C16 | C17 | H172 | H171 | 117.3° | 120.0° |
C17 | C16 | H162 | H161 | 117.1° | 120.0° |
C17 | C16 | C15 | H151 | 77.4° | 60.0° |
C17 | C16 | C15 | H152 | 40.5° | 60.0° |
C17 | C18 | H183 | H181 | 120.0° | 120.0° |
C17 | C18 | H183 | H182 | 120.0° | 120.0° |
C17 | C18 | H181 | H182 | 120.0° | 120.0° |
C18 | C17 | H172 | H171 | 117.3° | 120.0° |
C18 | C17 | C16 | H162 | 78.4° | 60.0° |
C18 | C17 | C16 | H161 | 39.7° | 60.0° |
C07 | C06 | C05 | C04 | 0.0° | 0.0° |
C07 | C06 | C05 | H061 | 180.0° | 180.0° |
C07 | C06 | C05 | H051 | 180.0° | 180.0° |
C06 | C07 | C08 | H081 | 179.7° | 179.7° |
C04 | C05 | C06 | H051 | 180.0° | 180.0° |
C04 | C05 | C06 | H061 | 180.0° | 180.0° |
C32 | C26 | C10 | C11 | 102.6° | 125.4° |
C32 | C26 | C10 | O27 | 124.2° | 119.5° |
C32 | C26 | C10 | H261 | 113.4° | 119.6° |
C32 | C26 | O27 | H261 | 119.8° | 121.0° |
C32 | C26 | O27 | S28 | 130.6° | 96.7° |
C32 | C26 | C10 | H101 | 135.2° | 108.0° |
C26 | C32 | H322 | H321 | 122.1° | 121.0° |
C26 | C32 | C33 | H331 | 158.1° | 137.2° |
C26 | C32 | C33 | H332 | 81.3° | 101.2° |
C06 | C05 | C04 | H041 | 179.6° | 179.9° |
C05 | C06 | C07 | H071 | 180.0° | 180.0° |
C11 | C10 | C26 | H101 | 122.2° | 126.6° |
C11 | C10 | C26 | O27 | 21.5° | 5.9° |
C11 | C10 | C26 | H261 | 144.0° | 115.0° |
C10 | C11 | H111 | H112 | 122.4° | 122.4° |
C10 | C26 | O27 | H261 | 121.3° | 120.9° |
C10 | C26 | O27 | S28 | 110.5° | 145.3° |
C26 | C10 | C11 | H111 | 137.8° | 155.9° |
C26 | C10 | C11 | H112 | 16.1° | 33.6° |
C10 | C26 | C32 | H322 | 86.7° | 119.6° |
C10 | C26 | C32 | H321 | 151.8° | 119.4° |
C26 | O27 | S28 | O31 | 52.3° | 171.5° |
C26 | O27 | S28 | N30 | 61.9° | 75.0° |
C26 | O27 | S28 | O29 | 179.9° | 38.5° |
O27 | C26 | C10 | H101 | 100.6° | 132.5° |
O27 | C26 | C32 | H322 | 39.5° | 120.9° |
O27 | C26 | C32 | H321 | 82.0° | 0.1° |
O27 | S28 | O31 | N30 | 110.5° | 114.1° |
O27 | S28 | O31 | O29 | 121.3° | 123.0° |
O27 | S28 | N30 | O29 | 118.1° | 113.5° |
S28 | O27 | C26 | H261 | 10.8° | 24.3° |
O27 | S28 | N30 | H301 | 180.0° | 0.0° |
O27 | S28 | N30 | H302 | 60.0° | 180.0° |
O31 | S28 | N30 | O29 | 133.4° | 132.9° |
O31 | S28 | N30 | H301 | 71.4° | 113.6° |
O31 | S28 | N30 | H302 | 48.6° | 66.4° |
S28 | N30 | H301 | H302 | 120.0° | 180.0° |
O29 | S28 | N30 | H301 | 61.9° | 113.5° |
O29 | S28 | N30 | H302 | 178.1° | 66.5° |
H251 | C25 | C24 | H241 | 0.3° | 0.4° |
H241 | C24 | C23 | H231 | 0.1° | 0.0° |
H261 | C26 | C10 | H101 | 21.8° | 11.5° |
H261 | C26 | C32 | H322 | 160.3° | 0.1° |
H261 | C26 | C32 | H321 | 38.8° | 121.0° |
H231 | C23 | C22 | H221 | 0.0° | 0.0° |
H221 | C22 | C21 | H211 | 0.5° | 0.0° |
H183 | C18 | H181 | H182 | 120.0° | 120.0° |
H183 | C18 | C17 | H172 | 59.1° | 180.0° |
H183 | C18 | C17 | H171 | 59.1° | 60.0° |
H181 | C18 | C17 | H172 | 179.2° | 60.0° |
H181 | C18 | C17 | H171 | 60.9° | 60.0° |
H182 | C18 | C17 | H172 | 60.8° | 60.0° |
H182 | C18 | C17 | H171 | 179.1° | 179.9° |
H172 | C17 | C16 | H162 | 160.7° | 180.0° |
H172 | C17 | C16 | H161 | 81.1° | 60.0° |
H171 | C17 | C16 | H162 | 42.4° | 60.0° |
H171 | C17 | C16 | H161 | 160.6° | 180.0° |
H162 | C16 | C15 | H151 | 43.5° | 180.0° |
H162 | C16 | C15 | H152 | 161.4° | 60.0° |
H161 | C16 | C15 | H151 | 161.7° | 60.0° |
H161 | C16 | C15 | H152 | 80.4° | 180.0° |
H151 | C15 | C14 | H142 | 82.0° | 180.0° |
H151 | C15 | C14 | H141 | 159.9° | 60.0° |
H152 | C15 | C14 | H142 | 160.1° | 59.9° |
H152 | C15 | C14 | H141 | 42.0° | 180.0° |
H111 | C11 | C10 | H101 | 15.8° | 29.4° |
H112 | C11 | C10 | H101 | 105.8° | 92.9° |
H131 | C13 | C14 | H142 | 58.1° | 60.0° |
H131 | C13 | C14 | H141 | 176.2° | 179.9° |
H132 | C13 | C14 | H142 | 59.3° | 180.0° |
H132 | C13 | C14 | H141 | 58.8° | 59.9° |
H041 | C04 | C05 | H051 | 0.4° | 0.1° |
H051 | C05 | C06 | H061 | 0.0° | 0.0° |
H061 | C06 | C07 | H071 | 0.0° | 0.0° |
H071 | C07 | C08 | H081 | 0.3° | 0.1° |
H322 | C32 | C33 | H331 | 38.8° | 103.4° |
H322 | C32 | C33 | H332 | 159.4° | 18.2° |
H321 | C32 | C33 | H331 | 82.7° | 17.8° |
H321 | C32 | C33 | H332 | 38.0° | 139.4° |