Y4X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N02 | C01 | sing | 1.47Å | 1.48Å | |
| C06 | N05 | sing | 1.35Å | 1.41Å | |
| C08 | C07 | sing | 1.51Å | 1.52Å | |
| C09 | C08 | doub | 1.34Å | 1.39Å | Aromatic |
| N10 | C09 | sing | 1.37Å | 1.29Å | Aromatic |
| C11 | N10 | sing | 1.38Å | 1.40Å | Aromatic |
| C12 | C11 | doub | 1.41Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.42Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| O15 | C14 | sing | 1.36Å | 1.41Å | |
| C16 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C07 | C06 | sing | 1.51Å | 1.53Å | |
| O18 | C06 | doub | 1.21Å | 1.20Å | |
| N05 | C04 | sing | 1.46Å | 1.45Å | |
| C19 | C04 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.51Å | 1.52Å | |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.36Å | Aromatic |
| F23 | C22 | sing | 1.35Å | 1.34Å | |
| C24 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.36Å | Aromatic |
| F26 | C25 | sing | 1.35Å | 1.37Å | |
| C27 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C04 | C03 | sing | 1.51Å | 1.53Å | |
| O28 | C03 | doub | 1.21Å | 1.21Å | |
| C03 | N02 | sing | 1.35Å | 1.41Å | |
| C29 | N02 | sing | 1.40Å | 1.42Å | |
| C30 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | C30 | sing | 1.41Å | 1.42Å | Aromatic |
| C33 | N32 | doub | 1.28Å | 1.37Å | Aromatic |
| S34 | C33 | sing | 1.71Å | 1.70Å | Aromatic |
| N32 | C31 | sing | 1.35Å | 1.45Å | Aromatic |
| C35 | C31 | doub | 1.40Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.39Å | 1.43Å | Aromatic |
| C37 | C36 | doub | 1.37Å | 1.39Å | Aromatic |
| C08 | C12 | sing | 1.46Å | 1.40Å | Aromatic |
| C11 | C17 | sing | 1.39Å | 1.44Å | Aromatic |
| C20 | C27 | sing | 1.38Å | 1.36Å | Aromatic |
| C29 | C37 | sing | 1.39Å | 1.42Å | Aromatic |
| S34 | C35 | sing | 1.76Å | 1.71Å | Aromatic |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| O15 | H151 | sing | 0.97Å | 0.95Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | N02 | C03 | 120.2° | 120.0° |
| C01 | N02 | C29 | 119.7° | 120.0° |
| N02 | C01 | H011 | 109.5° | 109.5° |
| N02 | C01 | H012 | 109.5° | 109.5° |
| N02 | C01 | H013 | 109.4° | 109.5° |
| N05 | C06 | C07 | 115.3° | 120.0° |
| N05 | C06 | O18 | 120.1° | 120.0° |
| C06 | N05 | C04 | 124.5° | 120.0° |
| C06 | N05 | H051 | 117.7° | 119.9° |
| C07 | C08 | C09 | 125.1° | 126.5° |
| C08 | C07 | C06 | 113.3° | 109.5° |
| C07 | C08 | C12 | 124.9° | 126.5° |
| C08 | C07 | H072 | 108.5° | 109.5° |
| C08 | C07 | H071 | 108.5° | 109.5° |
| C08 | C09 | N10 | 107.0° | 109.9° |
| C09 | C08 | C12 | 110.0° | 107.0° |
| C08 | C09 | H091 | 126.5° | 125.0° |
| C09 | N10 | C11 | 110.8° | 109.8° |
| N10 | C09 | H091 | 126.5° | 125.0° |
| C09 | N10 | H101 | 124.6° | 125.1° |
| N10 | C11 | C12 | 107.9° | 107.1° |
| N10 | C11 | C17 | 132.7° | 133.4° |
| C11 | N10 | H101 | 124.6° | 125.0° |
| C11 | C12 | C13 | 120.0° | 120.0° |
| C11 | C12 | C08 | 104.3° | 106.1° |
| C12 | C11 | C17 | 119.4° | 119.5° |
| C12 | C13 | C14 | 120.2° | 119.6° |
| C13 | C12 | C08 | 135.7° | 133.9° |
| C12 | C13 | H131 | 119.9° | 120.2° |
| C13 | C14 | O15 | 120.1° | 119.8° |
| C13 | C14 | C16 | 119.9° | 120.2° |
| C14 | C13 | H131 | 119.9° | 120.2° |
| O15 | C14 | C16 | 120.1° | 119.9° |
| C14 | O15 | H151 | 109.5° | 114.0° |
| C14 | C16 | C17 | 120.4° | 120.7° |
| C14 | C16 | H161 | 119.8° | 119.7° |
| C16 | C17 | C11 | 120.2° | 120.0° |
| C17 | C16 | H161 | 119.8° | 119.6° |
| C16 | C17 | H171 | 119.9° | 120.0° |
| C07 | C06 | O18 | 124.7° | 120.0° |
| C06 | C07 | H072 | 108.5° | 109.5° |
| C06 | C07 | H071 | 108.5° | 109.4° |
| N05 | C04 | C19 | 111.3° | 109.5° |
| N05 | C04 | C03 | 109.2° | 109.5° |
| N05 | C04 | H041 | 111.3° | 109.4° |
| C04 | N05 | H051 | 117.8° | 120.0° |
| C04 | C19 | C20 | 107.6° | 109.4° |
| C19 | C04 | C03 | 104.7° | 109.5° |
| C19 | C04 | H041 | 110.2° | 109.5° |
| C04 | C19 | H192 | 109.9° | 109.5° |
| C04 | C19 | H191 | 109.9° | 109.4° |
| C19 | C20 | C21 | 122.9° | 120.0° |
| C19 | C20 | C27 | 118.0° | 120.0° |
| C20 | C19 | H192 | 109.9° | 109.5° |
| C20 | C19 | H191 | 109.9° | 109.5° |
| C20 | C21 | C22 | 119.2° | 120.0° |
| C21 | C20 | C27 | 119.0° | 120.0° |
| C20 | C21 | H211 | 120.4° | 119.9° |
| C21 | C22 | F23 | 114.2° | 120.0° |
| C21 | C22 | C24 | 123.8° | 120.0° |
| C22 | C21 | H211 | 120.4° | 120.0° |
| F23 | C22 | C24 | 121.9° | 120.0° |
| C22 | C24 | C25 | 115.5° | 119.9° |
| C22 | C24 | H241 | 122.2° | 120.0° |
| C24 | C25 | F26 | 118.6° | 120.0° |
| C24 | C25 | C27 | 122.6° | 120.0° |
| C25 | C24 | H241 | 122.2° | 120.0° |
| F26 | C25 | C27 | 118.6° | 120.0° |
| C25 | C27 | C20 | 119.6° | 120.1° |
| C25 | C27 | H271 | 120.2° | 120.0° |
| C04 | C03 | O28 | 126.4° | 120.0° |
| C04 | C03 | N02 | 114.1° | 120.0° |
| C03 | C04 | H041 | 110.1° | 109.5° |
| O28 | C03 | N02 | 119.4° | 120.0° |
| C03 | N02 | C29 | 119.8° | 120.0° |
| N02 | C29 | C30 | 121.5° | 119.8° |
| N02 | C29 | C37 | 117.6° | 119.8° |
| C29 | C30 | C31 | 118.0° | 120.3° |
| C30 | C29 | C37 | 120.9° | 120.4° |
| C29 | C30 | H301 | 121.0° | 119.8° |
| C30 | C31 | N32 | 120.2° | 129.5° |
| C30 | C31 | C35 | 122.3° | 118.6° |
| C31 | C30 | H301 | 121.0° | 119.9° |
| N32 | C33 | S34 | 112.5° | 111.5° |
| C33 | N32 | C31 | 108.5° | 117.8° |
| N32 | C33 | H331 | 123.7° | 124.2° |
| C33 | S34 | C35 | 95.7° | 90.9° |
| S34 | C33 | H331 | 123.8° | 124.2° |
| N32 | C31 | C35 | 117.5° | 111.9° |
| C31 | C35 | C36 | 119.0° | 120.5° |
| C31 | C35 | S34 | 105.8° | 107.9° |
| C35 | C36 | C37 | 118.5° | 120.2° |
| C36 | C35 | S34 | 135.1° | 131.6° |
| C35 | C36 | H361 | 120.7° | 119.9° |
| C36 | C37 | C29 | 121.3° | 120.0° |
| C37 | C36 | H361 | 120.7° | 119.9° |
| C36 | C37 | H371 | 119.3° | 120.0° |
| C11 | C17 | H171 | 119.9° | 120.0° |
| C20 | C27 | H271 | 120.2° | 120.0° |
| C29 | C37 | H371 | 119.4° | 120.0° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H072 | C07 | H071 | 109.5° | 109.4° |
| H192 | C19 | H191 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | N02 | C03 | C04 | 178.9° | 5.5° |
| C01 | N02 | C03 | O28 | 1.3° | 174.5° |
| C01 | N02 | C03 | C29 | 174.9° | 180.0° |
| C01 | N02 | C29 | C30 | 99.9° | 114.6° |
| C01 | N02 | C29 | C37 | 78.3° | 65.2° |
| N02 | C01 | H011 | H012 | 120.0° | 120.0° |
| N02 | C01 | H011 | H013 | 120.0° | 120.0° |
| N02 | C01 | H012 | H013 | 120.0° | 120.0° |
| N05 | C06 | C07 | C08 | 113.0° | 180.0° |
| N05 | C06 | C07 | O18 | 179.1° | 180.0° |
| C06 | N05 | C04 | H051 | 180.0° | 180.0° |
| C06 | N05 | C04 | C19 | 146.5° | 85.0° |
| C06 | N05 | C04 | C03 | 98.4° | 155.0° |
| C06 | N05 | C04 | H041 | 23.2° | 35.0° |
| N05 | C06 | C07 | H072 | 7.6° | 59.9° |
| N05 | C06 | C07 | H071 | 126.5° | 60.0° |
| C07 | C08 | C09 | C12 | 177.6° | 179.9° |
| C07 | C08 | C09 | N10 | 179.4° | 180.0° |
| C07 | C08 | C12 | C11 | 179.1° | 179.9° |
| C07 | C08 | C12 | C13 | 3.1° | 0.4° |
| C08 | C07 | C06 | H072 | 120.6° | 120.0° |
| C08 | C07 | C06 | H071 | 120.6° | 120.0° |
| C08 | C07 | C06 | O18 | 68.0° | 0.0° |
| C08 | C07 | H072 | H071 | 118.2° | 120.0° |
| C07 | C08 | C09 | H091 | 0.6° | 0.1° |
| C08 | C09 | N10 | H091 | 180.0° | 179.9° |
| C08 | C09 | N10 | C11 | 1.3° | 0.0° |
| C09 | C08 | C12 | C11 | 1.5° | 0.0° |
| C09 | C08 | C12 | C13 | 179.3° | 179.7° |
| C09 | C08 | C07 | C06 | 83.9° | 94.9° |
| C09 | C08 | C07 | H072 | 36.7° | 145.1° |
| C09 | C08 | C07 | H071 | 155.5° | 25.1° |
| C08 | C09 | N10 | H101 | 178.7° | 180.0° |
| C09 | N10 | C11 | H101 | 180.0° | 180.0° |
| C09 | N10 | C11 | C12 | 0.4° | 0.0° |
| N10 | C09 | C08 | C12 | 1.8° | 0.0° |
| C09 | N10 | C11 | C17 | 179.9° | 180.0° |
| N10 | C11 | C12 | C17 | 179.6° | 180.0° |
| N10 | C11 | C12 | C13 | 179.0° | 179.8° |
| N10 | C11 | C17 | C16 | 179.5° | 180.0° |
| N10 | C11 | C12 | C08 | 0.7° | 0.0° |
| N10 | C11 | C17 | H171 | 0.5° | 0.0° |
| C11 | N10 | C09 | H091 | 178.7° | 179.9° |
| C11 | C12 | C13 | C08 | 177.5° | 179.7° |
| C11 | C12 | C13 | C14 | 0.5° | 0.5° |
| C12 | C11 | C17 | C16 | 0.0° | 0.0° |
| C11 | C12 | C13 | H131 | 179.5° | 180.0° |
| C12 | C11 | C17 | H171 | 180.0° | 180.0° |
| C12 | C11 | N10 | H101 | 179.7° | 180.0° |
| C12 | C13 | C14 | H131 | 180.0° | 179.5° |
| C12 | C13 | C14 | O15 | 178.7° | 179.5° |
| C12 | C13 | C14 | C16 | 0.4° | 0.5° |
| C13 | C12 | C11 | C17 | 0.7° | 0.3° |
| C13 | C14 | O15 | C16 | 179.0° | 180.0° |
| C13 | C14 | C16 | C17 | 1.0° | 0.2° |
| C14 | C13 | C12 | C08 | 178.1° | 179.8° |
| C13 | C14 | C16 | H161 | 179.0° | 180.0° |
| C13 | C14 | O15 | H151 | 180.0° | 90.1° |
| O15 | C14 | C16 | C17 | 178.0° | 179.8° |
| O15 | C14 | C16 | H161 | 2.0° | 0.0° |
| O15 | C14 | C13 | H131 | 1.4° | 0.0° |
| C14 | C16 | C17 | H161 | 180.0° | 179.8° |
| C14 | C16 | C17 | C11 | 0.9° | 0.0° |
| C16 | C14 | C13 | H131 | 179.6° | 180.0° |
| C14 | C16 | C17 | H171 | 179.1° | 180.0° |
| C16 | C14 | O15 | H151 | 1.0° | 89.9° |
| C16 | C17 | C11 | H171 | 180.0° | 180.0° |
| C07 | C06 | N05 | C04 | 179.0° | 180.0° |
| C06 | C07 | C08 | C12 | 93.4° | 85.0° |
| C07 | C06 | N05 | H051 | 1.0° | 0.0° |
| C06 | C07 | H072 | H071 | 118.2° | 119.9° |
| O18 | C06 | N05 | C04 | 0.2° | 0.0° |
| O18 | C06 | N05 | H051 | 179.8° | 180.0° |
| O18 | C06 | C07 | H072 | 171.5° | 120.0° |
| O18 | C06 | C07 | H071 | 52.6° | 120.0° |
| N05 | C04 | C19 | C03 | 117.8° | 120.0° |
| N05 | C04 | C19 | H041 | 123.9° | 120.0° |
| N05 | C04 | C19 | C20 | 69.1° | 65.0° |
| N05 | C04 | C03 | H041 | 122.4° | 120.0° |
| N05 | C04 | C03 | O28 | 33.6° | 0.0° |
| N05 | C04 | C03 | N02 | 146.1° | 180.0° |
| N05 | C04 | C19 | H192 | 50.6° | 55.0° |
| N05 | C04 | C19 | H191 | 171.2° | 175.0° |
| C04 | C19 | C20 | H192 | 119.7° | 120.0° |
| C04 | C19 | C20 | H191 | 119.7° | 119.9° |
| C04 | C19 | C20 | C21 | 83.7° | 89.7° |
| C19 | C04 | C03 | H041 | 118.4° | 120.0° |
| C19 | C04 | C03 | O28 | 85.5° | 120.0° |
| C19 | C04 | C03 | N02 | 94.7° | 60.0° |
| C04 | C19 | C20 | C27 | 97.2° | 90.0° |
| C19 | C04 | N05 | H051 | 33.4° | 95.0° |
| C04 | C19 | H192 | H191 | 120.9° | 120.0° |
| C19 | C20 | C21 | C27 | 179.1° | 179.7° |
| C19 | C20 | C21 | C22 | 178.9° | 179.9° |
| C19 | C20 | C27 | C25 | 176.5° | 179.7° |
| C20 | C19 | C04 | C03 | 173.1° | 175.0° |
| C20 | C19 | C04 | H041 | 54.8° | 55.0° |
| C20 | C19 | H192 | H191 | 120.9° | 120.0° |
| C19 | C20 | C21 | H211 | 1.1° | 0.0° |
| C19 | C20 | C27 | H271 | 3.4° | 0.0° |
| C20 | C21 | C22 | H211 | 180.0° | 179.9° |
| C20 | C21 | C22 | F23 | 177.6° | 180.0° |
| C20 | C21 | C22 | C24 | 0.4° | 0.1° |
| C21 | C20 | C27 | C25 | 2.6° | 0.5° |
| C21 | C20 | C19 | H192 | 36.0° | 150.3° |
| C21 | C20 | C19 | H191 | 156.6° | 30.2° |
| C21 | C20 | C27 | H271 | 177.4° | 179.7° |
| C21 | C22 | F23 | C24 | 177.3° | 179.9° |
| C21 | C22 | C24 | C25 | 2.8° | 0.1° |
| C22 | C21 | C20 | C27 | 0.2° | 0.3° |
| C21 | C22 | C24 | H241 | 177.2° | 180.0° |
| F23 | C22 | C24 | C25 | 179.8° | 180.0° |
| F23 | C22 | C21 | H211 | 2.4° | 0.1° |
| F23 | C22 | C24 | H241 | 0.2° | 0.1° |
| C22 | C24 | C25 | H241 | 180.0° | 179.9° |
| C22 | C24 | C25 | F26 | 179.9° | 180.0° |
| C22 | C24 | C25 | C27 | 5.3° | 0.3° |
| C24 | C22 | C21 | H211 | 179.6° | 180.0° |
| C24 | C25 | F26 | C27 | 175.0° | 179.7° |
| C24 | C25 | C27 | C20 | 5.4° | 0.5° |
| C24 | C25 | C27 | H271 | 174.6° | 179.7° |
| F26 | C25 | C27 | C20 | 179.8° | 179.8° |
| F26 | C25 | C24 | H241 | 0.1° | 0.1° |
| F26 | C25 | C27 | H271 | 0.2° | 0.0° |
| C25 | C27 | C20 | H271 | 180.0° | 179.8° |
| C27 | C25 | C24 | H241 | 174.7° | 179.8° |
| C04 | C03 | O28 | N02 | 179.7° | 180.0° |
| C04 | C03 | N02 | C29 | 4.0° | 174.5° |
| C03 | C04 | N05 | H051 | 81.6° | 25.0° |
| C03 | C04 | C19 | H192 | 67.1° | 65.1° |
| C03 | C04 | C19 | H191 | 53.4° | 55.0° |
| O28 | C03 | N02 | C29 | 176.3° | 5.4° |
| O28 | C03 | C04 | H041 | 156.0° | 120.0° |
| C03 | N02 | C29 | C30 | 85.2° | 65.4° |
| C03 | N02 | C29 | C37 | 96.6° | 114.8° |
| C03 | N02 | C01 | H011 | 180.0° | 90.0° |
| C03 | N02 | C01 | H012 | 60.0° | 150.0° |
| C03 | N02 | C01 | H013 | 60.0° | 30.0° |
| N02 | C03 | C04 | H041 | 23.7° | 60.0° |
| N02 | C29 | C30 | C37 | 178.1° | 179.7° |
| N02 | C29 | C30 | C31 | 178.3° | 180.0° |
| N02 | C29 | C37 | C36 | 179.3° | 179.8° |
| C29 | N02 | C01 | H011 | 5.1° | 90.0° |
| C29 | N02 | C01 | H012 | 114.9° | 30.0° |
| C29 | N02 | C01 | H013 | 125.1° | 150.0° |
| N02 | C29 | C30 | H301 | 1.7° | 0.0° |
| N02 | C29 | C37 | H371 | 0.8° | 0.1° |
| C29 | C30 | C31 | H301 | 180.0° | 180.0° |
| C29 | C30 | C31 | N32 | 177.8° | 179.9° |
| C29 | C30 | C31 | C35 | 0.2° | 0.0° |
| C30 | C29 | C37 | C36 | 1.0° | 0.5° |
| C30 | C29 | C37 | H371 | 179.0° | 179.7° |
| C30 | C31 | N32 | C33 | 179.9° | 179.9° |
| C30 | C31 | N32 | C35 | 178.1° | 179.9° |
| C30 | C31 | C35 | C36 | 1.2° | 0.1° |
| C31 | C30 | C29 | C37 | 0.1° | 0.3° |
| C30 | C31 | C35 | S34 | 178.6° | 180.0° |
| N32 | C33 | S34 | H331 | 180.0° | 180.0° |
| C33 | N32 | C31 | C35 | 1.7° | 0.0° |
| N32 | C33 | S34 | C35 | 1.7° | 0.0° |
| S34 | C33 | N32 | C31 | 2.1° | 0.0° |
| C33 | S34 | C35 | C31 | 0.6° | 0.0° |
| C33 | S34 | C35 | C36 | 177.4° | 180.0° |
| N32 | C31 | C35 | C36 | 176.9° | 180.0° |
| N32 | C31 | C35 | S34 | 0.5° | 0.0° |
| N32 | C31 | C30 | H301 | 2.2° | 0.0° |
| C31 | N32 | C33 | H331 | 177.9° | 180.0° |
| C31 | C35 | C36 | S34 | 176.5° | 180.0° |
| C31 | C35 | C36 | C37 | 2.0° | 0.1° |
| C35 | C31 | C30 | H301 | 179.8° | 180.0° |
| C31 | C35 | C36 | H361 | 178.0° | 180.0° |
| C35 | C36 | C37 | H361 | 180.0° | 179.9° |
| C35 | C36 | C37 | C29 | 2.0° | 0.4° |
| C35 | C36 | C37 | H371 | 178.0° | 179.7° |
| C36 | C37 | C29 | H371 | 180.0° | 179.9° |
| C37 | C36 | C35 | S34 | 178.5° | 179.8° |
| C08 | C12 | C11 | C17 | 178.9° | 180.0° |
| C08 | C12 | C13 | H131 | 2.0° | 0.4° |
| C12 | C08 | C07 | H072 | 146.1° | 35.0° |
| C12 | C08 | C07 | H071 | 27.2° | 155.0° |
| C12 | C08 | C09 | H091 | 178.3° | 179.9° |
| C11 | C17 | C16 | H161 | 179.1° | 179.7° |
| C17 | C11 | N10 | H101 | 0.1° | 0.0° |
| C27 | C20 | C19 | H192 | 143.1° | 30.0° |
| C27 | C20 | C19 | H191 | 22.5° | 150.0° |
| C27 | C20 | C21 | H211 | 179.7° | 179.8° |
| C37 | C29 | C30 | H301 | 179.9° | 179.8° |
| C29 | C37 | C36 | H361 | 178.0° | 179.7° |
| C35 | S34 | C33 | H331 | 178.3° | 179.9° |
| S34 | C35 | C36 | H361 | 1.5° | 0.0° |
| H161 | C16 | C17 | H171 | 0.9° | 0.3° |
| H011 | C01 | H012 | H013 | 120.0° | 120.0° |
| H041 | C04 | N05 | H051 | 156.8° | 145.0° |
| H041 | C04 | C19 | H192 | 174.6° | 174.9° |
| H041 | C04 | C19 | H191 | 64.9° | 65.0° |
| H091 | C09 | N10 | H101 | 1.2° | 0.1° |
| H361 | C36 | C37 | H371 | 2.0° | 0.1° |
