YSQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | doub | 1.36Å | 1.40Å | Aromatic |
| C20 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | C16 | sing | 1.41Å | 1.44Å | Aromatic |
| C22 | N15 | sing | 1.46Å | 1.44Å | |
| C19 | C18 | doub | 1.36Å | 1.40Å | Aromatic |
| C16 | N15 | doub | 1.34Å | 1.36Å | Aromatic |
| C16 | C17 | sing | 1.42Å | 1.40Å | Aromatic |
| N15 | C14 | sing | 1.31Å | 1.33Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.37Å | Aromatic |
| C32 | C31 | sing | 1.36Å | 1.38Å | Aromatic |
| C33 | C34 | sing | 1.36Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.42Å | Aromatic |
| C17 | C12 | doub | 1.46Å | 1.44Å | Aromatic |
| C31 | C30 | doub | 1.41Å | 1.41Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C34 | C29 | doub | 1.40Å | 1.41Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.47Å | 1.51Å | |
| C30 | C29 | sing | 1.42Å | 1.36Å | Aromatic |
| C30 | N35 | sing | 1.34Å | 1.36Å | Aromatic |
| C38 | N35 | sing | 1.46Å | 1.46Å | |
| C29 | C28 | sing | 1.46Å | 1.43Å | Aromatic |
| N35 | C36 | doub | 1.31Å | 1.32Å | Aromatic |
| C11 | N10 | doub | 1.30Å | 1.27Å | |
| C28 | C27 | sing | 1.47Å | 1.49Å | |
| C28 | C37 | doub | 1.39Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.39Å | 1.39Å | Aromatic |
| N10 | N09 | sing | 1.40Å | 1.41Å | |
| C27 | N26 | doub | 1.30Å | 1.24Å | |
| N09 | C08 | sing | 1.35Å | 1.42Å | |
| N26 | N25 | sing | 1.40Å | 1.38Å | |
| N25 | C02 | sing | 1.35Å | 1.42Å | |
| C08 | O23 | doub | 1.22Å | 1.19Å | |
| C08 | C07 | sing | 1.48Å | 1.52Å | |
| N24 | C07 | doub | 1.32Å | 1.32Å | Aromatic |
| N24 | C03 | sing | 1.32Å | 1.34Å | Aromatic |
| C02 | C03 | sing | 1.48Å | 1.52Å | |
| C02 | O01 | doub | 1.22Å | 1.21Å | |
| C07 | C06 | sing | 1.40Å | 1.39Å | Aromatic |
| C03 | C04 | doub | 1.40Å | 1.40Å | Aromatic |
| C06 | C05 | doub | 1.39Å | 1.40Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H223 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H383 | sing | 1.09Å | 1.10Å | |
| N09 | H091 | sing | 0.97Å | 1.00Å | |
| N25 | H251 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C19 | 121.5° | 121.1° |
| C20 | C21 | C16 | 117.7° | 119.7° |
| C21 | C20 | H201 | 119.2° | 119.5° |
| C20 | C21 | H211 | 121.1° | 120.1° |
| C20 | C19 | C18 | 120.1° | 120.8° |
| C19 | C20 | H201 | 119.2° | 119.5° |
| C20 | C19 | H191 | 120.0° | 119.6° |
| C21 | C16 | N15 | 120.2° | 121.2° |
| C21 | C16 | C17 | 121.7° | 119.0° |
| C16 | C21 | H211 | 121.2° | 120.2° |
| C22 | N15 | C16 | 117.4° | 118.8° |
| C22 | N15 | C14 | 120.1° | 118.8° |
| N15 | C22 | H222 | 109.5° | 109.5° |
| N15 | C22 | H223 | 109.5° | 109.5° |
| N15 | C22 | H221 | 109.5° | 109.5° |
| C19 | C18 | C17 | 120.8° | 119.5° |
| C19 | C18 | H181 | 119.6° | 120.2° |
| C18 | C19 | H191 | 120.0° | 119.6° |
| N15 | C16 | C17 | 118.1° | 119.9° |
| C16 | N15 | C14 | 122.5° | 122.4° |
| C16 | C17 | C18 | 118.2° | 119.9° |
| C16 | C17 | C12 | 120.3° | 118.5° |
| N15 | C14 | C13 | 122.4° | 122.6° |
| N15 | C14 | H141 | 118.8° | 118.7° |
| C33 | C32 | C31 | 120.9° | 121.1° |
| C32 | C33 | C34 | 120.6° | 120.8° |
| C33 | C32 | H321 | 119.5° | 119.5° |
| C32 | C33 | H331 | 119.7° | 119.6° |
| C32 | C31 | C30 | 118.2° | 119.7° |
| C32 | C31 | H311 | 120.9° | 120.1° |
| C31 | C32 | H321 | 119.5° | 119.5° |
| C33 | C34 | C29 | 119.6° | 119.5° |
| C34 | C33 | H331 | 119.7° | 119.6° |
| C33 | C34 | H341 | 120.2° | 120.2° |
| C18 | C17 | C12 | 121.5° | 121.6° |
| C17 | C18 | H181 | 119.6° | 120.2° |
| C17 | C12 | C13 | 118.6° | 117.1° |
| C17 | C12 | C11 | 121.9° | 121.4° |
| C31 | C30 | C29 | 121.5° | 118.9° |
| C31 | C30 | N35 | 118.3° | 121.1° |
| C30 | C31 | H311 | 120.9° | 120.2° |
| C14 | C13 | C12 | 118.0° | 119.5° |
| C14 | C13 | H131 | 121.0° | 120.3° |
| C13 | C14 | H141 | 118.8° | 118.7° |
| C34 | C29 | C30 | 119.1° | 120.0° |
| C34 | C29 | C28 | 123.5° | 121.6° |
| C29 | C34 | H341 | 120.2° | 120.2° |
| C13 | C12 | C11 | 119.4° | 121.4° |
| C12 | C13 | H131 | 121.0° | 120.2° |
| C12 | C11 | N10 | 120.7° | 120.0° |
| C12 | C11 | H111 | 119.7° | 120.0° |
| C29 | C30 | N35 | 120.2° | 119.9° |
| C30 | C29 | C28 | 117.4° | 118.4° |
| C30 | N35 | C38 | 119.6° | 118.8° |
| C30 | N35 | C36 | 123.2° | 122.4° |
| C38 | N35 | C36 | 117.2° | 118.8° |
| N35 | C38 | H382 | 109.5° | 109.5° |
| N35 | C38 | H381 | 109.5° | 109.5° |
| N35 | C38 | H383 | 109.4° | 109.5° |
| C29 | C28 | C27 | 121.5° | 121.4° |
| C29 | C28 | C37 | 121.2° | 117.2° |
| N35 | C36 | C37 | 121.0° | 122.6° |
| N35 | C36 | H361 | 119.5° | 118.6° |
| C11 | N10 | N09 | 109.6° | 120.0° |
| N10 | C11 | H111 | 119.6° | 120.1° |
| C27 | C28 | C37 | 117.3° | 121.4° |
| C28 | C27 | N26 | 118.8° | 120.0° |
| C28 | C27 | H271 | 120.6° | 120.0° |
| C28 | C37 | C36 | 117.0° | 119.5° |
| C28 | C37 | H371 | 121.5° | 120.3° |
| C37 | C36 | H361 | 119.5° | 118.7° |
| C36 | C37 | H371 | 121.5° | 120.3° |
| N10 | N09 | C08 | 117.3° | 120.0° |
| N10 | N09 | H091 | 121.3° | 120.0° |
| C27 | N26 | N25 | 113.7° | 120.0° |
| N26 | C27 | H271 | 120.6° | 120.0° |
| N09 | C08 | O23 | 117.5° | 120.0° |
| N09 | C08 | C07 | 115.4° | 120.0° |
| C08 | N09 | H091 | 121.4° | 120.0° |
| N26 | N25 | C02 | 116.3° | 120.0° |
| N26 | N25 | H251 | 121.8° | 120.0° |
| N25 | C02 | C03 | 115.4° | 120.0° |
| N25 | C02 | O01 | 122.1° | 120.0° |
| C02 | N25 | H251 | 121.8° | 120.0° |
| O23 | C08 | C07 | 127.1° | 120.0° |
| C08 | C07 | N24 | 120.4° | 119.6° |
| C08 | C07 | C06 | 119.4° | 119.6° |
| C07 | N24 | C03 | 121.8° | 121.5° |
| N24 | C07 | C06 | 120.1° | 120.7° |
| N24 | C03 | C02 | 119.4° | 119.7° |
| N24 | C03 | C04 | 121.8° | 120.6° |
| C03 | C02 | O01 | 122.4° | 120.0° |
| C02 | C03 | C04 | 118.7° | 119.7° |
| C07 | C06 | C05 | 119.9° | 119.2° |
| C07 | C06 | H061 | 120.0° | 120.4° |
| C03 | C04 | C05 | 117.4° | 119.3° |
| C03 | C04 | H041 | 121.3° | 120.3° |
| C06 | C05 | C04 | 119.0° | 118.6° |
| C06 | C05 | H051 | 120.5° | 120.7° |
| C05 | C06 | H061 | 120.1° | 120.4° |
| C05 | C04 | H041 | 121.3° | 120.4° |
| C04 | C05 | H051 | 120.5° | 120.7° |
| H222 | C22 | H223 | 109.5° | 109.5° |
| H222 | C22 | H221 | 109.5° | 109.4° |
| H223 | C22 | H221 | 109.5° | 109.5° |
| H382 | C38 | H381 | 109.5° | 109.5° |
| H382 | C38 | H383 | 109.5° | 109.4° |
| H381 | C38 | H383 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C19 | H201 | 180.0° | 179.9° |
| C20 | C21 | C16 | H211 | 180.0° | 179.9° |
| C21 | C20 | C19 | C18 | 0.4° | 0.1° |
| C20 | C21 | C16 | N15 | 179.1° | 179.8° |
| C20 | C21 | C16 | C17 | 0.2° | 0.1° |
| C21 | C20 | C19 | H191 | 179.6° | 180.0° |
| C19 | C20 | C21 | C16 | 0.2° | 0.1° |
| C20 | C19 | C18 | H191 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.1° | 0.0° |
| C19 | C20 | C21 | H211 | 179.8° | 180.0° |
| C20 | C19 | C18 | H181 | 179.9° | 180.0° |
| C21 | C16 | N15 | C22 | 0.2° | 0.1° |
| C21 | C16 | N15 | C17 | 178.9° | 179.7° |
| C21 | C16 | N15 | C14 | 179.3° | 180.0° |
| C21 | C16 | C17 | C18 | 0.5° | 0.0° |
| C21 | C16 | C17 | C12 | 179.7° | 179.9° |
| C16 | C21 | C20 | H201 | 179.8° | 180.0° |
| C22 | N15 | C16 | C14 | 179.5° | 180.0° |
| C22 | N15 | C16 | C17 | 178.7° | 179.8° |
| C22 | N15 | C14 | C13 | 178.8° | 180.0° |
| N15 | C22 | H222 | H223 | 120.0° | 120.1° |
| N15 | C22 | H222 | H221 | 120.0° | 120.0° |
| N15 | C22 | H223 | H221 | 120.0° | 120.0° |
| C22 | N15 | C14 | H141 | 1.2° | 0.1° |
| C19 | C18 | C17 | C16 | 0.4° | 0.0° |
| C19 | C18 | C17 | H181 | 180.0° | 180.0° |
| C19 | C18 | C17 | C12 | 179.6° | 180.0° |
| C18 | C19 | C20 | H201 | 179.6° | 180.0° |
| N15 | C16 | C17 | C18 | 179.4° | 179.7° |
| N15 | C16 | C17 | C12 | 1.4° | 0.2° |
| C16 | N15 | C14 | C13 | 1.7° | 0.0° |
| N15 | C16 | C21 | H211 | 0.9° | 0.3° |
| C16 | N15 | C22 | H222 | 180.0° | 90.0° |
| C16 | N15 | C22 | H223 | 60.0° | 150.0° |
| C16 | N15 | C22 | H221 | 60.0° | 30.0° |
| C16 | N15 | C14 | H141 | 178.3° | 180.0° |
| C17 | C16 | N15 | C14 | 1.8° | 0.2° |
| C16 | C17 | C18 | C12 | 179.2° | 179.9° |
| C16 | C17 | C12 | C13 | 0.9° | 0.1° |
| C16 | C17 | C12 | C11 | 177.8° | 180.0° |
| C17 | C16 | C21 | H211 | 179.8° | 180.0° |
| C16 | C17 | C18 | H181 | 179.7° | 179.9° |
| N15 | C14 | C13 | H141 | 180.0° | 179.9° |
| N15 | C14 | C13 | C12 | 1.1° | 0.3° |
| N15 | C14 | C13 | H131 | 178.9° | 179.9° |
| C14 | N15 | C22 | H222 | 0.5° | 90.0° |
| C14 | N15 | C22 | H223 | 119.5° | 30.0° |
| C14 | N15 | C22 | H221 | 120.5° | 150.0° |
| C33 | C32 | C31 | H321 | 180.0° | 179.9° |
| C32 | C33 | C34 | H331 | 180.0° | 179.9° |
| C33 | C32 | C31 | C30 | 2.5° | 0.0° |
| C32 | C33 | C34 | C29 | 1.4° | 0.1° |
| C33 | C32 | C31 | H311 | 177.4° | 180.0° |
| C32 | C33 | C34 | H341 | 178.5° | 180.0° |
| C31 | C32 | C33 | C34 | 2.2° | 0.1° |
| C32 | C31 | C30 | H311 | 180.0° | 180.0° |
| C32 | C31 | C30 | C29 | 2.3° | 0.0° |
| C32 | C31 | C30 | N35 | 178.7° | 180.0° |
| C31 | C32 | C33 | H331 | 177.8° | 180.0° |
| C33 | C34 | C29 | H341 | 180.0° | 180.0° |
| C33 | C34 | C29 | C30 | 1.1° | 0.0° |
| C33 | C34 | C29 | C28 | 179.8° | 180.0° |
| C34 | C33 | C32 | H321 | 177.9° | 180.0° |
| C18 | C17 | C12 | C13 | 179.9° | 180.0° |
| C18 | C17 | C12 | C11 | 1.4° | 0.0° |
| C17 | C18 | C19 | H191 | 179.9° | 179.9° |
| C17 | C12 | C13 | C14 | 0.7° | 0.3° |
| C17 | C12 | C13 | C11 | 178.7° | 179.9° |
| C17 | C12 | C11 | N10 | 176.4° | 5.3° |
| C17 | C12 | C13 | H131 | 179.3° | 180.0° |
| C17 | C12 | C11 | H111 | 3.6° | 174.7° |
| C12 | C17 | C18 | H181 | 0.5° | 0.0° |
| C31 | C30 | C29 | C34 | 1.6° | 0.0° |
| C31 | C30 | C29 | N35 | 179.0° | 180.0° |
| C31 | C30 | N35 | C38 | 0.5° | 0.0° |
| C31 | C30 | C29 | C28 | 179.3° | 180.0° |
| C31 | C30 | N35 | C36 | 179.3° | 179.7° |
| C30 | C31 | C32 | H321 | 177.5° | 179.9° |
| C14 | C13 | C12 | H131 | 180.0° | 179.7° |
| C14 | C13 | C12 | C11 | 178.0° | 179.8° |
| C34 | C29 | C30 | C28 | 179.1° | 180.0° |
| C34 | C29 | C30 | N35 | 179.4° | 180.0° |
| C34 | C29 | C28 | C27 | 3.5° | 0.0° |
| C34 | C29 | C28 | C37 | 179.5° | 179.7° |
| C29 | C34 | C33 | H331 | 178.6° | 180.0° |
| C13 | C12 | C11 | N10 | 2.3° | 174.6° |
| C13 | C12 | C11 | H111 | 177.7° | 5.4° |
| C12 | C13 | C14 | H141 | 178.9° | 179.7° |
| C12 | C11 | N10 | H111 | 180.0° | 180.0° |
| C12 | C11 | N10 | N09 | 177.1° | 180.0° |
| C11 | C12 | C13 | H131 | 2.0° | 0.1° |
| C29 | C30 | N35 | C38 | 179.6° | 180.0° |
| C29 | C30 | N35 | C36 | 0.2° | 0.3° |
| C30 | C29 | C28 | C27 | 177.5° | 180.0° |
| C30 | C29 | C28 | C37 | 0.5° | 0.3° |
| C29 | C30 | C31 | H311 | 177.7° | 180.0° |
| C30 | C29 | C34 | H341 | 178.8° | 180.0° |
| C30 | N35 | C38 | C36 | 179.8° | 179.7° |
| N35 | C30 | C29 | C28 | 0.3° | 0.0° |
| C30 | N35 | C36 | C37 | 0.3° | 0.3° |
| N35 | C30 | C31 | H311 | 1.4° | 0.0° |
| C30 | N35 | C36 | H361 | 179.7° | 179.8° |
| C30 | N35 | C38 | H382 | 180.0° | 90.0° |
| C30 | N35 | C38 | H381 | 60.0° | 150.0° |
| C30 | N35 | C38 | H383 | 60.0° | 30.0° |
| C38 | N35 | C36 | C37 | 179.5° | 179.9° |
| C38 | N35 | C36 | H361 | 0.5° | 0.0° |
| N35 | C38 | H382 | H381 | 120.0° | 120.0° |
| N35 | C38 | H382 | H383 | 120.0° | 120.0° |
| N35 | C38 | H381 | H383 | 120.0° | 120.1° |
| C29 | C28 | C27 | C37 | 177.1° | 179.7° |
| C29 | C28 | C37 | C36 | 0.6° | 0.2° |
| C29 | C28 | C27 | N26 | 179.1° | 5.0° |
| C29 | C28 | C27 | H271 | 0.9° | 174.9° |
| C28 | C29 | C34 | H341 | 0.2° | 0.0° |
| C29 | C28 | C37 | H371 | 179.4° | 179.7° |
| N35 | C36 | C37 | C28 | 0.5° | 0.0° |
| N35 | C36 | C37 | H361 | 180.0° | 179.9° |
| N35 | C36 | C37 | H371 | 179.5° | 180.0° |
| C36 | N35 | C38 | H382 | 0.2° | 89.8° |
| C36 | N35 | C38 | H381 | 119.8° | 30.2° |
| C36 | N35 | C38 | H383 | 120.2° | 150.3° |
| C11 | N10 | N09 | C08 | 175.4° | 180.0° |
| C11 | N10 | N09 | H091 | 4.6° | 0.0° |
| C27 | C28 | C37 | C36 | 177.7° | 180.0° |
| C28 | C27 | N26 | H271 | 180.0° | 179.9° |
| C28 | C27 | N26 | N25 | 177.7° | 180.0° |
| C27 | C28 | C37 | H371 | 2.3° | 0.0° |
| C28 | C37 | C36 | H371 | 180.0° | 180.0° |
| C37 | C28 | C27 | N26 | 2.0° | 174.7° |
| C37 | C28 | C27 | H271 | 178.0° | 5.4° |
| C28 | C37 | C36 | H361 | 179.5° | 180.0° |
| N10 | N09 | C08 | H091 | 180.0° | 180.0° |
| N10 | N09 | C08 | O23 | 4.0° | 0.0° |
| N10 | N09 | C08 | C07 | 175.4° | 180.0° |
| N09 | N10 | C11 | H111 | 2.9° | 0.0° |
| C27 | N26 | N25 | C02 | 176.2° | 180.0° |
| C27 | N26 | N25 | H251 | 3.8° | 0.1° |
| N09 | C08 | O23 | C07 | 179.3° | 180.0° |
| N09 | C08 | C07 | N24 | 6.9° | 0.3° |
| N09 | C08 | C07 | C06 | 177.0° | 180.0° |
| N26 | N25 | C02 | H251 | 180.0° | 179.9° |
| N26 | N25 | C02 | C03 | 173.8° | 179.9° |
| N26 | N25 | C02 | O01 | 2.4° | 0.0° |
| N25 | N26 | C27 | H271 | 2.3° | 0.1° |
| N25 | C02 | C03 | N24 | 2.6° | 0.2° |
| N25 | C02 | C03 | O01 | 176.2° | 179.9° |
| N25 | C02 | C03 | C04 | 174.4° | 180.0° |
| O23 | C08 | C07 | N24 | 172.4° | 179.7° |
| O23 | C08 | C07 | C06 | 3.7° | 0.0° |
| O23 | C08 | N09 | H091 | 176.0° | 180.0° |
| C08 | C07 | N24 | C06 | 176.1° | 179.7° |
| C08 | C07 | N24 | C03 | 177.8° | 179.8° |
| C08 | C07 | C06 | C05 | 178.7° | 180.0° |
| C08 | C07 | C06 | H061 | 1.3° | 0.1° |
| C07 | C08 | N09 | H091 | 4.6° | 0.0° |
| C07 | N24 | C03 | C02 | 177.0° | 179.7° |
| C07 | N24 | C03 | C04 | 0.0° | 0.5° |
| N24 | C07 | C06 | C05 | 2.6° | 0.3° |
| N24 | C07 | C06 | H061 | 177.4° | 179.8° |
| N24 | C03 | C02 | C04 | 177.0° | 179.8° |
| N24 | C03 | C02 | O01 | 178.9° | 179.7° |
| C03 | N24 | C07 | C06 | 1.7° | 0.5° |
| N24 | C03 | C04 | C05 | 0.9° | 0.3° |
| N24 | C03 | C04 | H041 | 179.1° | 179.8° |
| C02 | C03 | C04 | C05 | 177.9° | 179.9° |
| C02 | C03 | C04 | H041 | 2.1° | 0.0° |
| C03 | C02 | N25 | H251 | 6.2° | 0.0° |
| O01 | C02 | C03 | C04 | 1.9° | 0.0° |
| O01 | C02 | N25 | H251 | 177.6° | 179.9° |
| C07 | C06 | C05 | H061 | 180.0° | 179.9° |
| C07 | C06 | C05 | C04 | 1.7° | 0.1° |
| C07 | C06 | C05 | H051 | 178.3° | 180.0° |
| C03 | C04 | C05 | C06 | 0.0° | 0.1° |
| C03 | C04 | C05 | H041 | 180.0° | 179.9° |
| C03 | C04 | C05 | H051 | 180.0° | 180.0° |
| C06 | C05 | C04 | H051 | 180.0° | 179.9° |
| C06 | C05 | C04 | H041 | 180.0° | 180.0° |
| C04 | C05 | C06 | H061 | 178.3° | 180.0° |
| H131 | C13 | C14 | H141 | 1.1° | 0.0° |
| H201 | C20 | C21 | H211 | 0.2° | 0.1° |
| H201 | C20 | C19 | H191 | 0.4° | 0.1° |
| H222 | C22 | H223 | H221 | 120.0° | 120.0° |
| H041 | C04 | C05 | H051 | 0.0° | 0.1° |
| H051 | C05 | C06 | H061 | 1.7° | 0.1° |
| H181 | C18 | C19 | H191 | 0.1° | 0.1° |
| H311 | C31 | C32 | H321 | 2.5° | 0.1° |
| H321 | C32 | C33 | H331 | 2.2° | 0.1° |
| H331 | C33 | C34 | H341 | 1.5° | 0.0° |
| H361 | C36 | C37 | H371 | 0.5° | 0.1° |
| H382 | C38 | H381 | H383 | 120.0° | 119.9° |
