EKL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C10 | N09 | sing | 1.46Å | 1.45Å | |
C10 | C11 | sing | 1.51Å | 1.53Å | |
C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
O22 | C08 | doub | 1.22Å | 1.19Å | |
N09 | C08 | sing | 1.35Å | 1.45Å | |
C11 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
C08 | C07 | sing | 1.48Å | 1.52Å | |
C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
C07 | C06 | doub | 1.39Å | 1.39Å | Aromatic |
C07 | C23 | sing | 1.40Å | 1.40Å | Aromatic |
C06 | C05 | sing | 1.39Å | 1.41Å | Aromatic |
C32 | C31 | sing | 1.54Å | 1.53Å | |
C32 | C29 | sing | 1.54Å | 1.53Å | |
C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
O28 | C27 | sing | 1.36Å | 1.40Å | |
O28 | C29 | sing | 1.43Å | 1.40Å | |
C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
C26 | C25 | sing | 1.39Å | 1.41Å | Aromatic |
C23 | C24 | doub | 1.36Å | 1.39Å | Aromatic |
C05 | C25 | sing | 1.47Å | 1.45Å | Aromatic |
C05 | C04 | doub | 1.41Å | 1.38Å | Aromatic |
C14 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
C14 | S15 | sing | 1.76Å | 1.82Å | |
C31 | C30 | sing | 1.54Å | 1.53Å | |
C27 | C33 | sing | 1.39Å | 1.40Å | Aromatic |
C25 | C35 | doub | 1.40Å | 1.37Å | Aromatic |
C29 | C30 | sing | 1.54Å | 1.53Å | |
O19 | S15 | doub | 1.42Å | 1.49Å | |
C24 | C04 | sing | 1.39Å | 1.42Å | Aromatic |
C04 | N03 | sing | 1.38Å | 1.36Å | Aromatic |
C33 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
C35 | N03 | sing | 1.39Å | 1.36Å | Aromatic |
C35 | C34 | sing | 1.39Å | 1.42Å | Aromatic |
S15 | C16 | sing | 1.81Å | 1.83Å | |
S15 | O18 | doub | 1.42Å | 1.44Å | |
N03 | C02 | sing | 1.47Å | 1.45Å | |
C16 | C17 | sing | 1.53Å | 1.53Å | |
C02 | C01 | sing | 1.53Å | 1.53Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C10 | H102 | sing | 1.09Å | 1.10Å | |
C13 | H131 | sing | 1.08Å | 1.08Å | |
C17 | H173 | sing | 1.09Å | 1.10Å | |
C17 | H171 | sing | 1.09Å | 1.10Å | |
C17 | H172 | sing | 1.09Å | 1.10Å | |
C20 | H201 | sing | 1.08Å | 1.08Å | |
C21 | H211 | sing | 1.08Å | 1.08Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C26 | H261 | sing | 1.08Å | 1.08Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C02 | H022 | sing | 1.09Å | 1.10Å | |
C02 | H021 | sing | 1.09Å | 1.10Å | |
C06 | H061 | sing | 1.08Å | 1.08Å | |
C12 | H121 | sing | 1.08Å | 1.08Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C23 | H231 | sing | 1.08Å | 1.08Å | |
C29 | H291 | sing | 1.09Å | 1.10Å | |
C30 | H302 | sing | 1.09Å | 1.10Å | |
C30 | H301 | sing | 1.09Å | 1.10Å | |
C31 | H311 | sing | 1.09Å | 1.10Å | |
C31 | H312 | sing | 1.09Å | 1.10Å | |
C32 | H322 | sing | 1.09Å | 1.10Å | |
C32 | H321 | sing | 1.09Å | 1.10Å | |
C33 | H331 | sing | 1.08Å | 1.08Å | |
C34 | H341 | sing | 1.08Å | 1.08Å | |
N09 | H091 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N09 | C10 | C11 | 106.0° | 109.5° |
C10 | N09 | C08 | 121.2° | 120.0° |
N09 | C10 | H101 | 110.4° | 109.5° |
N09 | C10 | H102 | 110.4° | 109.5° |
C10 | N09 | H091 | 119.4° | 120.0° |
C10 | C11 | C12 | 120.6° | 120.0° |
C10 | C11 | C21 | 119.5° | 120.0° |
C11 | C10 | H101 | 110.3° | 109.5° |
C11 | C10 | H102 | 110.3° | 109.5° |
C11 | C12 | C13 | 119.9° | 120.0° |
C12 | C11 | C21 | 119.9° | 120.0° |
C11 | C12 | H121 | 120.1° | 120.0° |
C12 | C13 | C14 | 119.8° | 120.0° |
C12 | C13 | H131 | 120.1° | 120.0° |
C13 | C12 | H121 | 120.1° | 120.0° |
O22 | C08 | N09 | 121.8° | 120.0° |
O22 | C08 | C07 | 120.5° | 120.0° |
N09 | C08 | C07 | 117.7° | 120.0° |
C08 | N09 | H091 | 119.4° | 120.0° |
C11 | C21 | C20 | 120.3° | 120.0° |
C11 | C21 | H211 | 119.9° | 120.0° |
C08 | C07 | C06 | 119.8° | 120.0° |
C08 | C07 | C23 | 120.1° | 120.1° |
C13 | C14 | C20 | 120.8° | 120.0° |
C13 | C14 | S15 | 119.8° | 120.0° |
C14 | C13 | H131 | 120.1° | 120.0° |
C06 | C07 | C23 | 120.1° | 119.9° |
C07 | C06 | C05 | 119.5° | 119.5° |
C07 | C06 | H061 | 120.2° | 120.2° |
C07 | C23 | C24 | 120.3° | 120.5° |
C07 | C23 | H231 | 119.8° | 119.7° |
C06 | C05 | C25 | 132.7° | 133.4° |
C06 | C05 | C04 | 120.9° | 120.1° |
C05 | C06 | H061 | 120.2° | 120.3° |
C31 | C32 | C29 | 90.0° | 87.0° |
C32 | C31 | C30 | 89.5° | 87.1° |
C32 | C31 | H311 | 114.2° | 113.6° |
C32 | C31 | H312 | 114.2° | 113.7° |
C31 | C32 | H322 | 114.1° | 113.6° |
C31 | C32 | H321 | 114.1° | 113.6° |
C32 | C29 | O28 | 106.9° | 113.6° |
C32 | C29 | C30 | 89.0° | 87.1° |
C32 | C29 | H291 | 112.2° | 113.7° |
C29 | C32 | H322 | 114.1° | 113.6° |
C29 | C32 | H321 | 114.1° | 113.6° |
C21 | C20 | C14 | 119.4° | 120.0° |
C21 | C20 | H201 | 120.3° | 120.0° |
C20 | C21 | H211 | 119.9° | 120.0° |
C27 | O28 | C29 | 122.6° | 117.0° |
O28 | C27 | C26 | 115.0° | 119.9° |
O28 | C27 | C33 | 125.4° | 120.0° |
O28 | C29 | C30 | 119.0° | 113.6° |
O28 | C29 | H291 | 114.4° | 112.8° |
C27 | C26 | C25 | 120.5° | 119.7° |
C26 | C27 | C33 | 119.5° | 120.1° |
C27 | C26 | H261 | 119.7° | 120.2° |
C26 | C25 | C05 | 133.2° | 133.5° |
C26 | C25 | C35 | 120.3° | 120.1° |
C25 | C26 | H261 | 119.8° | 120.1° |
C23 | C24 | C04 | 119.5° | 120.4° |
C23 | C24 | H241 | 120.2° | 119.8° |
C24 | C23 | H231 | 119.8° | 119.7° |
C25 | C05 | C04 | 106.4° | 106.5° |
C05 | C25 | C35 | 106.5° | 106.5° |
C05 | C04 | C24 | 119.6° | 119.6° |
C05 | C04 | N03 | 108.6° | 108.4° |
C20 | C14 | S15 | 119.5° | 120.0° |
C14 | C20 | H201 | 120.3° | 119.9° |
C14 | S15 | O19 | 107.9° | 104.2° |
C14 | S15 | C16 | 109.0° | 104.4° |
C14 | S15 | O18 | 111.6° | 104.3° |
C31 | C30 | C29 | 90.0° | 87.0° |
C31 | C30 | H302 | 114.1° | 113.6° |
C31 | C30 | H301 | 114.1° | 113.7° |
C30 | C31 | H311 | 114.2° | 113.6° |
C30 | C31 | H312 | 114.2° | 113.6° |
C27 | C33 | C34 | 119.8° | 120.5° |
C27 | C33 | H331 | 120.1° | 119.7° |
C25 | C35 | N03 | 108.7° | 108.3° |
C25 | C35 | C34 | 119.1° | 119.4° |
C30 | C29 | H291 | 112.2° | 113.6° |
C29 | C30 | H302 | 114.1° | 113.6° |
C29 | C30 | H301 | 114.1° | 113.6° |
O19 | S15 | C16 | 110.5° | 110.5° |
O19 | S15 | O18 | 108.1° | 121.0° |
C24 | C04 | N03 | 131.8° | 132.1° |
C04 | C24 | H241 | 120.2° | 119.8° |
C04 | N03 | C35 | 109.8° | 110.4° |
C04 | N03 | C02 | 125.2° | 124.8° |
C33 | C34 | C35 | 120.7° | 120.1° |
C34 | C33 | H331 | 120.1° | 119.8° |
C33 | C34 | H341 | 119.7° | 119.9° |
N03 | C35 | C34 | 132.2° | 132.2° |
C35 | N03 | C02 | 125.0° | 124.8° |
C35 | C34 | H341 | 119.6° | 120.0° |
C16 | S15 | O18 | 109.7° | 110.6° |
S15 | C16 | C17 | 110.5° | 109.5° |
S15 | C16 | H162 | 109.2° | 109.4° |
S15 | C16 | H161 | 109.2° | 109.5° |
N03 | C02 | C01 | 110.3° | 109.5° |
N03 | C02 | H022 | 109.3° | 109.5° |
N03 | C02 | H021 | 109.3° | 109.5° |
C16 | C17 | H173 | 109.5° | 109.5° |
C16 | C17 | H171 | 109.5° | 109.5° |
C16 | C17 | H172 | 109.5° | 109.5° |
C17 | C16 | H162 | 109.2° | 109.5° |
C17 | C16 | H161 | 109.2° | 109.5° |
C02 | C01 | H013 | 109.5° | 109.5° |
C02 | C01 | H011 | 109.4° | 109.5° |
C02 | C01 | H012 | 109.5° | 109.5° |
C01 | C02 | H022 | 109.3° | 109.5° |
C01 | C02 | H021 | 109.3° | 109.5° |
H101 | C10 | H102 | 109.4° | 109.4° |
H173 | C17 | H171 | 109.5° | 109.5° |
H173 | C17 | H172 | 109.5° | 109.5° |
H171 | C17 | H172 | 109.5° | 109.5° |
H013 | C01 | H011 | 109.5° | 109.4° |
H013 | C01 | H012 | 109.4° | 109.5° |
H011 | C01 | H012 | 109.5° | 109.5° |
H022 | C02 | H021 | 109.4° | 109.5° |
H162 | C16 | H161 | 109.4° | 109.5° |
H302 | C30 | H301 | 109.5° | 112.9° |
H311 | C31 | H312 | 109.5° | 112.8° |
H322 | C32 | H321 | 109.5° | 112.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N09 | C10 | C11 | H101 | 119.5° | 120.1° |
N09 | C10 | C11 | H102 | 119.5° | 120.0° |
N09 | C10 | C11 | C12 | 161.0° | 89.2° |
C10 | N09 | C08 | O22 | 2.9° | 0.0° |
C10 | N09 | C08 | H091 | 180.0° | 179.9° |
N09 | C10 | C11 | C21 | 17.8° | 90.0° |
C10 | N09 | C08 | C07 | 177.5° | 180.0° |
N09 | C10 | H101 | H102 | 121.6° | 120.0° |
C10 | C11 | C12 | C21 | 178.8° | 179.2° |
C10 | C11 | C12 | C13 | 179.2° | 179.7° |
C11 | C10 | N09 | C08 | 84.9° | 180.0° |
C10 | C11 | C21 | C20 | 179.0° | 180.0° |
C11 | C10 | H101 | H102 | 121.6° | 120.0° |
C10 | C11 | C21 | H211 | 1.1° | 0.6° |
C10 | C11 | C12 | H121 | 0.8° | 0.2° |
C11 | C10 | N09 | H091 | 95.1° | 0.1° |
C11 | C12 | C13 | H121 | 180.0° | 179.9° |
C11 | C12 | C13 | C14 | 0.3° | 0.0° |
C12 | C11 | C21 | C20 | 0.1° | 0.8° |
C12 | C11 | C10 | H101 | 41.5° | 30.8° |
C12 | C11 | C10 | H102 | 79.5° | 150.8° |
C11 | C12 | C13 | H131 | 179.7° | 179.8° |
C12 | C11 | C21 | H211 | 179.9° | 179.8° |
C13 | C12 | C11 | C21 | 0.4° | 0.5° |
C12 | C13 | C14 | H131 | 180.0° | 179.8° |
C12 | C13 | C14 | C20 | 0.1° | 0.2° |
C12 | C13 | C14 | S15 | 179.7° | 179.7° |
O22 | C08 | N09 | C07 | 179.6° | 180.0° |
O22 | C08 | C07 | C06 | 16.8° | 0.0° |
O22 | C08 | C07 | C23 | 161.4° | 179.8° |
O22 | C08 | N09 | H091 | 177.0° | 180.0° |
N09 | C08 | C07 | C06 | 162.8° | 180.0° |
N09 | C08 | C07 | C23 | 19.0° | 0.3° |
C08 | N09 | C10 | H101 | 34.6° | 59.9° |
C08 | N09 | C10 | H102 | 155.6° | 60.0° |
C11 | C21 | C20 | H211 | 180.0° | 179.4° |
C11 | C21 | C20 | C14 | 0.2° | 0.6° |
C21 | C11 | C10 | H101 | 137.3° | 149.9° |
C21 | C11 | C10 | H102 | 101.6° | 30.0° |
C11 | C21 | C20 | H201 | 179.9° | 179.5° |
C21 | C11 | C12 | H121 | 179.6° | 179.5° |
C08 | C07 | C06 | C23 | 178.2° | 179.8° |
C08 | C07 | C06 | C05 | 179.3° | 180.0° |
C08 | C07 | C23 | C24 | 179.6° | 179.7° |
C08 | C07 | C06 | H061 | 0.7° | 0.0° |
C08 | C07 | C23 | H231 | 0.4° | 0.3° |
C07 | C08 | N09 | H091 | 2.6° | 0.0° |
C13 | C14 | C20 | C21 | 0.2° | 0.1° |
C13 | C14 | C20 | S15 | 179.7° | 179.9° |
C13 | C14 | S15 | O19 | 30.9° | 26.0° |
C13 | C14 | S15 | C16 | 89.1° | 90.0° |
C13 | C14 | S15 | O18 | 149.5° | 153.9° |
C13 | C14 | C20 | H201 | 179.8° | 179.9° |
C14 | C13 | C12 | H121 | 179.6° | 179.9° |
C07 | C06 | C05 | H061 | 180.0° | 180.0° |
C06 | C07 | C23 | C24 | 2.1° | 0.5° |
C07 | C06 | C05 | C25 | 179.3° | 180.0° |
C07 | C06 | C05 | C04 | 0.2° | 0.0° |
C06 | C07 | C23 | H231 | 177.8° | 179.9° |
C23 | C07 | C06 | C05 | 1.1° | 0.2° |
C07 | C23 | C24 | H231 | 180.0° | 179.4° |
C07 | C23 | C24 | C04 | 1.9° | 0.5° |
C07 | C23 | C24 | H241 | 178.0° | 179.7° |
C23 | C07 | C06 | H061 | 178.9° | 179.8° |
C06 | C05 | C25 | C26 | 1.1° | 0.0° |
C06 | C05 | C25 | C04 | 179.2° | 180.0° |
C06 | C05 | C25 | C35 | 179.7° | 180.0° |
C06 | C05 | C04 | C24 | 0.4° | 0.0° |
C06 | C05 | C04 | N03 | 179.6° | 180.0° |
C31 | C32 | C29 | H322 | 116.5° | 114.6° |
C31 | C32 | C29 | H321 | 116.6° | 114.5° |
C31 | C32 | C29 | O28 | 129.5° | 140.0° |
C32 | C31 | C30 | H311 | 116.5° | 114.6° |
C32 | C31 | C30 | H312 | 116.5° | 114.6° |
C31 | C32 | C29 | C30 | 9.4° | 25.5° |
C31 | C32 | C29 | H291 | 104.2° | 89.1° |
C32 | C31 | C30 | H302 | 107.1° | 140.0° |
C32 | C31 | C30 | H301 | 126.0° | 89.1° |
C32 | C31 | H311 | H312 | 129.5° | 131.3° |
C31 | C32 | H322 | H321 | 129.3° | 131.3° |
C32 | C29 | O28 | C27 | 153.6° | 104.6° |
C32 | C29 | O28 | C30 | 98.5° | 97.5° |
C32 | C29 | O28 | H291 | 124.9° | 131.3° |
C32 | C29 | C30 | H291 | 113.6° | 114.6° |
C32 | C29 | C30 | H302 | 107.1° | 140.0° |
C32 | C29 | C30 | H301 | 126.0° | 89.1° |
C29 | C32 | C31 | H311 | 125.9° | 89.1° |
C29 | C32 | C31 | H312 | 107.0° | 140.0° |
C29 | C32 | H322 | H321 | 129.2° | 131.3° |
C21 | C20 | C14 | H201 | 180.0° | 179.9° |
C21 | C20 | C14 | S15 | 179.9° | 180.0° |
O28 | C27 | C26 | C33 | 176.4° | 180.0° |
O28 | C27 | C26 | C25 | 177.8° | 180.0° |
C27 | O28 | C29 | C30 | 55.1° | 157.9° |
O28 | C27 | C33 | C34 | 178.0° | 179.9° |
O28 | C27 | C26 | H261 | 2.2° | 0.0° |
C27 | O28 | C29 | H291 | 81.6° | 26.7° |
O28 | C27 | C33 | H331 | 2.1° | 0.0° |
C29 | O28 | C27 | C26 | 149.2° | 6.0° |
O28 | C29 | C30 | C31 | 118.3° | 140.0° |
C29 | O28 | C27 | C33 | 34.6° | 174.0° |
O28 | C29 | C30 | H291 | 137.5° | 130.8° |
O28 | C29 | C30 | H302 | 1.7° | 105.5° |
O28 | C29 | C30 | H301 | 125.1° | 25.4° |
O28 | C29 | C32 | H322 | 113.9° | 25.5° |
O28 | C29 | C32 | H321 | 13.0° | 105.5° |
C27 | C26 | C25 | H261 | 180.0° | 180.0° |
C27 | C26 | C25 | C05 | 179.0° | 180.0° |
C27 | C26 | C25 | C35 | 0.1° | 0.0° |
C26 | C27 | C33 | C34 | 2.0° | 0.1° |
C26 | C27 | C33 | H331 | 178.1° | 180.0° |
C26 | C25 | C05 | C35 | 179.2° | 180.0° |
C26 | C25 | C05 | C04 | 179.8° | 180.0° |
C25 | C26 | C27 | C33 | 1.4° | 0.0° |
C26 | C25 | C35 | N03 | 179.9° | 180.0° |
C26 | C25 | C35 | C34 | 0.5° | 0.0° |
C23 | C24 | C04 | C05 | 0.7° | 0.3° |
C23 | C24 | C04 | H241 | 180.0° | 179.7° |
C23 | C24 | C04 | N03 | 179.3° | 179.8° |
C25 | C05 | C04 | C24 | 179.7° | 180.0° |
C25 | C05 | C04 | N03 | 0.4° | 0.0° |
C05 | C25 | C35 | N03 | 0.5° | 0.0° |
C05 | C25 | C35 | C34 | 179.9° | 179.9° |
C05 | C25 | C26 | H261 | 1.0° | 0.0° |
C25 | C05 | C06 | H061 | 0.8° | 0.0° |
C04 | C05 | C25 | C35 | 0.5° | 0.0° |
C05 | C04 | C24 | N03 | 180.0° | 180.0° |
C05 | C04 | N03 | C35 | 0.1° | 0.0° |
C05 | C04 | N03 | C02 | 179.7° | 180.0° |
C05 | C04 | C24 | H241 | 179.3° | 180.0° |
C04 | C05 | C06 | H061 | 179.8° | 180.0° |
C20 | C14 | S15 | O19 | 149.4° | 153.8° |
C20 | C14 | S15 | C16 | 90.6° | 90.1° |
C20 | C14 | S15 | O18 | 30.7° | 26.0° |
C20 | C14 | C13 | H131 | 180.0° | 180.0° |
C14 | C20 | C21 | H211 | 179.8° | 180.0° |
C14 | S15 | O19 | C16 | 119.1° | 111.7° |
C14 | S15 | O19 | O18 | 120.8° | 116.7° |
C14 | S15 | C16 | O18 | 122.4° | 111.6° |
C14 | S15 | C16 | C17 | 44.8° | 180.0° |
S15 | C14 | C13 | H131 | 0.3° | 0.1° |
S15 | C14 | C20 | H201 | 0.1° | 0.1° |
C14 | S15 | C16 | H162 | 75.4° | 60.0° |
C14 | S15 | C16 | H161 | 165.0° | 60.0° |
C31 | C30 | C29 | H302 | 116.5° | 114.5° |
C31 | C30 | C29 | H301 | 116.6° | 114.6° |
C31 | C30 | C29 | H291 | 104.2° | 89.1° |
C31 | C30 | H302 | H301 | 129.3° | 131.3° |
C30 | C31 | H311 | H312 | 129.5° | 131.2° |
C30 | C31 | C32 | H322 | 126.0° | 89.1° |
C30 | C31 | C32 | H321 | 107.1° | 140.0° |
C27 | C33 | C34 | H331 | 180.0° | 179.9° |
C27 | C33 | C34 | C35 | 1.3° | 0.2° |
C33 | C27 | C26 | H261 | 178.6° | 180.0° |
C27 | C33 | C34 | H341 | 178.7° | 180.0° |
C25 | C35 | N03 | C04 | 0.3° | 0.0° |
C25 | C35 | C34 | C33 | 0.1° | 0.1° |
C25 | C35 | N03 | C34 | 179.5° | 179.9° |
C25 | C35 | N03 | C02 | 179.3° | 180.0° |
C35 | C25 | C26 | H261 | 179.9° | 180.0° |
C25 | C35 | C34 | H341 | 179.9° | 180.0° |
C29 | C30 | H302 | H301 | 129.2° | 131.2° |
C29 | C30 | C31 | H311 | 125.9° | 89.1° |
C29 | C30 | C31 | H312 | 107.0° | 140.1° |
C30 | C29 | C32 | H322 | 126.0° | 89.1° |
C30 | C29 | C32 | H321 | 107.1° | 140.0° |
O19 | S15 | C16 | O18 | 119.1° | 136.8° |
O19 | S15 | C16 | C17 | 163.2° | 68.4° |
O19 | S15 | C16 | H162 | 43.1° | 171.6° |
O19 | S15 | C16 | H161 | 76.6° | 51.6° |
C24 | C04 | N03 | C35 | 180.0° | 180.0° |
C24 | C04 | N03 | C02 | 0.3° | 0.0° |
C04 | C24 | C23 | H231 | 178.0° | 180.0° |
C04 | N03 | C35 | C02 | 179.6° | 180.0° |
C04 | N03 | C35 | C34 | 179.8° | 179.9° |
C04 | N03 | C02 | C01 | 94.2° | 90.0° |
N03 | C04 | C24 | H241 | 0.7° | 0.0° |
C04 | N03 | C02 | H022 | 26.0° | 30.0° |
C04 | N03 | C02 | H021 | 145.7° | 150.0° |
C33 | C34 | C35 | N03 | 179.4° | 180.0° |
C33 | C34 | C35 | H341 | 180.0° | 179.9° |
C35 | N03 | C02 | C01 | 86.3° | 90.0° |
C35 | N03 | C02 | H022 | 153.6° | 150.0° |
C35 | N03 | C02 | H021 | 33.9° | 30.0° |
N03 | C35 | C34 | H341 | 0.6° | 0.1° |
C34 | C35 | N03 | C02 | 0.2° | 0.1° |
C35 | C34 | C33 | H331 | 178.7° | 179.9° |
S15 | C16 | C17 | H162 | 120.1° | 120.0° |
S15 | C16 | C17 | H161 | 120.2° | 120.0° |
S15 | C16 | C17 | H173 | 180.0° | 60.0° |
S15 | C16 | C17 | H171 | 60.0° | 60.0° |
S15 | C16 | C17 | H172 | 60.0° | 180.0° |
S15 | C16 | H162 | H161 | 119.5° | 120.0° |
O18 | S15 | C16 | C17 | 77.6° | 68.4° |
O18 | S15 | C16 | H162 | 162.2° | 51.6° |
O18 | S15 | C16 | H161 | 42.5° | 171.6° |
N03 | C02 | C01 | H022 | 120.1° | 120.0° |
N03 | C02 | C01 | H021 | 120.1° | 120.0° |
N03 | C02 | C01 | H013 | 180.0° | 180.0° |
N03 | C02 | C01 | H011 | 60.0° | 60.0° |
N03 | C02 | C01 | H012 | 60.0° | 60.0° |
N03 | C02 | H022 | H021 | 119.6° | 120.0° |
C16 | C17 | H173 | H171 | 120.0° | 120.0° |
C16 | C17 | H173 | H172 | 120.0° | 120.0° |
C16 | C17 | H171 | H172 | 120.0° | 120.0° |
C17 | C16 | H162 | H161 | 119.6° | 120.0° |
C02 | C01 | H013 | H011 | 120.0° | 120.0° |
C02 | C01 | H013 | H012 | 120.0° | 120.0° |
C02 | C01 | H011 | H012 | 120.0° | 120.1° |
C01 | C02 | H022 | H021 | 119.6° | 120.0° |
H101 | C10 | N09 | H091 | 145.4° | 120.0° |
H102 | C10 | N09 | H091 | 24.4° | 120.0° |
H131 | C13 | C12 | H121 | 0.4° | 0.3° |
H173 | C17 | H171 | H172 | 120.0° | 120.0° |
H173 | C17 | C16 | H162 | 59.9° | 60.0° |
H173 | C17 | C16 | H161 | 59.8° | 180.0° |
H171 | C17 | C16 | H162 | 179.9° | 180.0° |
H171 | C17 | C16 | H161 | 60.2° | 60.0° |
H172 | C17 | C16 | H162 | 60.2° | 60.1° |
H172 | C17 | C16 | H161 | 179.8° | 60.0° |
H201 | C20 | C21 | H211 | 0.2° | 0.0° |
H241 | C24 | C23 | H231 | 2.0° | 0.3° |
H013 | C01 | H011 | H012 | 120.0° | 120.0° |
H013 | C01 | C02 | H022 | 59.9° | 60.0° |
H013 | C01 | C02 | H021 | 59.9° | 60.0° |
H011 | C01 | C02 | H022 | 179.9° | 59.9° |
H011 | C01 | C02 | H021 | 60.2° | 180.0° |
H012 | C01 | C02 | H022 | 60.1° | 180.0° |
H012 | C01 | C02 | H021 | 179.9° | 60.0° |
H291 | C29 | C30 | H302 | 139.2° | 25.3° |
H291 | C29 | C30 | H301 | 12.4° | 156.3° |
H291 | C29 | C32 | H322 | 12.3° | 156.3° |
H291 | C29 | C32 | H321 | 139.2° | 25.4° |
H302 | C30 | C31 | H311 | 9.4° | 25.4° |
H302 | C30 | C31 | H312 | 136.4° | 105.4° |
H301 | C30 | C31 | H311 | 117.5° | 156.3° |
H301 | C30 | C31 | H312 | 9.5° | 25.5° |
H311 | C31 | C32 | H322 | 117.6° | 156.3° |
H311 | C31 | C32 | H321 | 9.4° | 25.4° |
H312 | C31 | C32 | H322 | 9.5° | 25.5° |
H312 | C31 | C32 | H321 | 136.5° | 105.5° |
H331 | C33 | C34 | H341 | 1.3° | 0.1° |