F3K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C33 | C34 | doub | 1.35Å | 1.42Å | Aromatic |
| C33 | C31 | sing | 1.41Å | 1.40Å | Aromatic |
| C34 | C35 | sing | 1.41Å | 1.40Å | Aromatic |
| N10 | C31 | doub | 1.33Å | 1.37Å | Aromatic |
| N10 | C30 | sing | 1.32Å | 1.37Å | Aromatic |
| C31 | C32 | sing | 1.42Å | 1.39Å | Aromatic |
| C35 | N12 | doub | 1.33Å | 1.36Å | Aromatic |
| C35 | C36 | sing | 1.42Å | 1.39Å | Aromatic |
| N12 | C37 | sing | 1.32Å | 1.37Å | Aromatic |
| C30 | C29 | doub | 1.40Å | 1.40Å | Aromatic |
| C32 | C36 | sing | 1.43Å | 1.40Å | Aromatic |
| C32 | N09 | doub | 1.31Å | 1.34Å | Aromatic |
| C36 | N11 | doub | 1.32Å | 1.35Å | Aromatic |
| C37 | C38 | doub | 1.39Å | 1.40Å | Aromatic |
| C29 | N09 | sing | 1.32Å | 1.36Å | Aromatic |
| N09 | RU1 | sing | 2.04Å | 2.07Å | |
| N11 | C38 | sing | 1.32Å | 1.35Å | Aromatic |
| N11 | RU1 | sing | 2.03Å | 2.08Å | |
| C19 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | N05 | sing | 1.32Å | 1.35Å | Aromatic |
| C20 | N06 | sing | 1.32Å | 1.37Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | N03 | sing | 1.32Å | 1.36Å | Aromatic |
| N05 | RU1 | sing | 2.04Å | 2.06Å | |
| N05 | C21 | doub | 1.31Å | 1.36Å | Aromatic |
| RU1 | N03 | sing | 2.03Å | 2.06Å | |
| RU1 | N04 | sing | 2.04Å | 2.08Å | |
| RU1 | N08 | sing | 2.03Å | 2.07Å | |
| C11 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| N06 | C22 | doub | 1.33Å | 1.36Å | Aromatic |
| N03 | C13 | doub | 1.31Å | 1.35Å | Aromatic |
| C21 | C22 | sing | 1.41Å | 1.39Å | Aromatic |
| C21 | C28 | sing | 1.44Å | 1.42Å | Aromatic |
| C10 | C09 | doub | 1.39Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.42Å | 1.40Å | Aromatic |
| C13 | C09 | sing | 1.41Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.45Å | 1.40Å | Aromatic |
| N04 | C16 | doub | 1.32Å | 1.35Å | Aromatic |
| N04 | C14 | sing | 1.32Å | 1.36Å | Aromatic |
| C16 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C09 | C07 | sing | 1.48Å | 1.39Å | Aromatic |
| N08 | C28 | doub | 1.32Å | 1.35Å | Aromatic |
| N08 | C27 | sing | 1.32Å | 1.35Å | Aromatic |
| C14 | C15 | doub | 1.41Å | 1.40Å | Aromatic |
| C28 | C25 | sing | 1.41Å | 1.40Å | Aromatic |
| C23 | C24 | doub | 1.35Å | 1.41Å | Aromatic |
| C17 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | N01 | doub | 1.32Å | 1.35Å | Aromatic |
| C07 | C08 | sing | 1.42Å | 1.43Å | Aromatic |
| C27 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C18 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | C08 | sing | 1.47Å | 1.40Å | Aromatic |
| N01 | C05 | sing | 1.33Å | 1.35Å | Aromatic |
| C25 | C24 | sing | 1.42Å | 1.40Å | Aromatic |
| C25 | N07 | doub | 1.33Å | 1.36Å | Aromatic |
| C08 | N02 | doub | 1.32Å | 1.36Å | Aromatic |
| C26 | N07 | sing | 1.32Å | 1.36Å | Aromatic |
| C05 | C04 | doub | 1.41Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.46Å | 1.41Å | Aromatic |
| N02 | C06 | sing | 1.33Å | 1.36Å | Aromatic |
| C04 | C01 | sing | 1.36Å | 1.40Å | Aromatic |
| C06 | C03 | doub | 1.41Å | 1.39Å | Aromatic |
| C01 | C02 | doub | 1.40Å | 1.40Å | Aromatic |
| C01 | BR1 | sing | 1.89Å | 1.91Å | |
| C03 | C02 | sing | 1.36Å | 1.40Å | Aromatic |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | 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 | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | C33 | C31 | 120.7° | 121.4° |
| C33 | C34 | C35 | 120.6° | 121.4° |
| C34 | C33 | H331 | 119.6° | 119.2° |
| C33 | C34 | H341 | 119.7° | 119.2° |
| C33 | C31 | N10 | 122.7° | 122.2° |
| C33 | C31 | C32 | 117.8° | 119.1° |
| C31 | C33 | H331 | 119.6° | 119.4° |
| C34 | C35 | N12 | 122.7° | 122.3° |
| C34 | C35 | C36 | 118.2° | 119.2° |
| C35 | C34 | H341 | 119.7° | 119.4° |
| C31 | N10 | C30 | 120.0° | 119.7° |
| N10 | C31 | C32 | 119.5° | 118.7° |
| N10 | C30 | C29 | 120.1° | 120.9° |
| N10 | C30 | H301 | 120.0° | 119.6° |
| C31 | C32 | C36 | 121.8° | 119.6° |
| C31 | C32 | N09 | 120.0° | 120.9° |
| N12 | C35 | C36 | 119.0° | 118.5° |
| C35 | N12 | C37 | 120.6° | 119.9° |
| C35 | C36 | C32 | 120.8° | 119.3° |
| C35 | C36 | N11 | 120.1° | 121.2° |
| N12 | C37 | C38 | 119.9° | 121.0° |
| N12 | C37 | H371 | 120.0° | 119.5° |
| C30 | C29 | N09 | 118.3° | 120.0° |
| C30 | C29 | H291 | 120.8° | 119.9° |
| C29 | C30 | H301 | 120.0° | 119.5° |
| C36 | C32 | N09 | 118.2° | 119.5° |
| C32 | C36 | N11 | 119.1° | 119.5° |
| C32 | N09 | C29 | 122.1° | 119.7° |
| C32 | N09 | RU1 | 111.7° | 108.4° |
| C36 | N11 | C38 | 121.9° | 119.5° |
| C36 | N11 | RU1 | 110.4° | 108.5° |
| C37 | C38 | N11 | 118.4° | 120.0° |
| C38 | C37 | H371 | 120.0° | 119.5° |
| C37 | C38 | H381 | 120.8° | 120.0° |
| C29 | N09 | RU1 | 126.2° | 131.9° |
| N09 | C29 | H291 | 120.8° | 120.1° |
| N09 | RU1 | N11 | 80.6° | 84.1° |
| N09 | RU1 | N05 | 93.8° | 91.9° |
| N09 | RU1 | N03 | 95.8° | 89.5° |
| N09 | RU1 | N04 | 94.6° | 88.8° |
| N09 | RU1 | N08 | 174.0° | 175.0° |
| C38 | N11 | RU1 | 127.7° | 132.1° |
| N11 | C38 | H381 | 120.8° | 120.0° |
| N11 | RU1 | N05 | 88.9° | 92.2° |
| N11 | RU1 | N03 | 95.2° | 91.2° |
| N11 | RU1 | N04 | 173.1° | 171.6° |
| N11 | RU1 | N08 | 93.7° | 92.7° |
| C20 | C19 | N05 | 118.2° | 120.0° |
| C19 | C20 | N06 | 120.4° | 121.1° |
| C20 | C19 | H191 | 120.9° | 119.9° |
| C19 | C20 | H201 | 119.8° | 119.5° |
| C19 | N05 | RU1 | 130.5° | 132.1° |
| C19 | N05 | C21 | 121.7° | 119.6° |
| N05 | C19 | H191 | 120.9° | 120.0° |
| C20 | N06 | C22 | 120.7° | 119.4° |
| N06 | C20 | H201 | 119.8° | 119.4° |
| C11 | C12 | N03 | 119.2° | 121.2° |
| C12 | C11 | C10 | 119.4° | 119.5° |
| C12 | C11 | H111 | 120.3° | 120.1° |
| C11 | C12 | H121 | 120.4° | 119.4° |
| C12 | N03 | RU1 | 125.3° | 130.3° |
| C12 | N03 | C13 | 122.3° | 121.5° |
| N03 | C12 | H121 | 120.4° | 119.4° |
| RU1 | N05 | C21 | 107.8° | 108.3° |
| N05 | RU1 | N03 | 170.1° | 176.4° |
| N05 | RU1 | N04 | 96.5° | 92.5° |
| N05 | RU1 | N08 | 84.1° | 84.3° |
| N05 | C21 | C22 | 120.3° | 120.9° |
| N05 | C21 | C28 | 120.2° | 119.5° |
| N03 | RU1 | N04 | 80.2° | 84.2° |
| N03 | RU1 | N08 | 86.6° | 94.4° |
| RU1 | N03 | C13 | 112.4° | 108.3° |
| N04 | RU1 | N08 | 91.2° | 94.7° |
| RU1 | N04 | C16 | 127.2° | 130.9° |
| RU1 | N04 | C14 | 111.8° | 107.8° |
| RU1 | N08 | C28 | 108.6° | 108.5° |
| RU1 | N08 | C27 | 129.9° | 132.5° |
| C11 | C10 | C09 | 120.1° | 118.2° |
| C10 | C11 | H111 | 120.3° | 120.4° |
| C11 | C10 | H101 | 119.9° | 120.9° |
| N06 | C22 | C21 | 118.7° | 118.9° |
| N06 | C22 | C23 | 121.8° | 122.0° |
| N03 | C13 | C09 | 120.8° | 120.4° |
| N03 | C13 | C14 | 118.4° | 118.9° |
| C22 | C21 | C28 | 119.4° | 119.5° |
| C21 | C22 | C23 | 119.5° | 119.1° |
| C21 | C28 | N08 | 119.3° | 119.4° |
| C21 | C28 | C25 | 121.4° | 119.4° |
| C10 | C09 | C13 | 118.2° | 119.0° |
| C10 | C09 | C07 | 122.5° | 121.6° |
| C09 | C10 | H101 | 119.9° | 120.9° |
| C22 | C23 | C24 | 120.9° | 121.4° |
| C22 | C23 | H231 | 119.5° | 119.4° |
| C09 | C13 | C14 | 120.8° | 120.7° |
| C13 | C09 | C07 | 119.3° | 119.4° |
| C13 | C14 | N04 | 117.3° | 119.5° |
| C13 | C14 | C15 | 120.7° | 120.2° |
| C16 | N04 | C14 | 121.0° | 121.3° |
| N04 | C16 | C17 | 119.9° | 121.3° |
| N04 | C16 | H161 | 120.1° | 119.4° |
| N04 | C14 | C15 | 122.0° | 120.3° |
| C16 | C17 | C18 | 119.7° | 119.5° |
| C16 | C17 | H171 | 120.1° | 120.1° |
| C17 | C16 | H161 | 120.1° | 119.3° |
| C09 | C07 | N01 | 119.3° | 120.2° |
| C09 | C07 | C08 | 120.3° | 119.1° |
| C28 | N08 | C27 | 121.5° | 119.0° |
| N08 | C28 | C25 | 119.4° | 121.3° |
| N08 | C27 | C26 | 118.8° | 120.5° |
| N08 | C27 | H271 | 120.6° | 119.8° |
| C14 | C15 | C18 | 117.3° | 119.1° |
| C14 | C15 | C08 | 118.8° | 119.6° |
| C28 | C25 | C24 | 118.7° | 119.1° |
| C28 | C25 | N07 | 120.3° | 118.9° |
| C23 | C24 | C25 | 120.1° | 121.4° |
| C23 | C24 | H241 | 120.0° | 119.2° |
| C24 | C23 | H231 | 119.5° | 119.2° |
| C17 | C18 | C15 | 120.1° | 118.1° |
| C18 | C17 | H171 | 120.2° | 120.5° |
| C17 | C18 | H181 | 119.9° | 121.0° |
| N01 | C07 | C08 | 120.4° | 120.7° |
| C07 | N01 | C05 | 120.5° | 119.7° |
| C07 | C08 | C15 | 120.0° | 120.0° |
| C07 | C08 | N02 | 118.6° | 120.8° |
| C27 | C26 | N07 | 120.7° | 121.0° |
| C27 | C26 | H261 | 119.7° | 119.5° |
| C26 | C27 | H271 | 120.6° | 119.8° |
| C18 | C15 | C08 | 123.9° | 121.4° |
| C15 | C18 | H181 | 120.0° | 121.0° |
| C15 | C08 | N02 | 121.4° | 119.2° |
| N01 | C05 | C04 | 119.9° | 122.1° |
| N01 | C05 | C06 | 119.5° | 119.4° |
| C24 | C25 | N07 | 121.0° | 122.0° |
| C25 | C24 | H241 | 119.9° | 119.4° |
| C25 | N07 | C26 | 119.4° | 119.4° |
| C08 | N02 | C06 | 120.6° | 119.8° |
| N07 | C26 | H261 | 119.7° | 119.5° |
| C04 | C05 | C06 | 120.5° | 118.5° |
| C05 | C04 | C01 | 120.2° | 120.0° |
| C05 | C04 | H041 | 119.9° | 120.1° |
| C05 | C06 | N02 | 120.4° | 119.4° |
| C05 | C06 | C03 | 119.3° | 119.0° |
| N02 | C06 | C03 | 120.3° | 121.6° |
| C04 | C01 | C02 | 119.6° | 121.3° |
| C04 | C01 | BR1 | 119.5° | 119.3° |
| C01 | C04 | H041 | 119.9° | 119.9° |
| C06 | C03 | C02 | 120.0° | 119.6° |
| C06 | C03 | H031 | 120.0° | 120.2° |
| C02 | C01 | BR1 | 120.9° | 119.4° |
| C01 | C02 | C03 | 120.3° | 121.5° |
| C01 | C02 | H021 | 119.9° | 119.1° |
| C03 | C02 | H021 | 119.8° | 119.4° |
| C02 | C03 | H031 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C34 | C33 | C31 | H331 | 180.0° | 179.8° |
| C33 | C34 | C35 | H341 | 180.0° | 180.0° |
| C34 | C33 | C31 | N10 | 179.8° | 179.5° |
| C34 | C33 | C31 | C32 | 0.7° | 0.4° |
| C33 | C34 | C35 | N12 | 180.0° | 179.5° |
| C33 | C34 | C35 | C36 | 0.5° | 0.5° |
| C31 | C33 | C34 | C35 | 0.8° | 0.0° |
| C33 | C31 | N10 | C32 | 179.4° | 179.9° |
| C33 | C31 | N10 | C30 | 179.6° | 179.9° |
| C33 | C31 | C32 | C36 | 0.3° | 0.3° |
| C33 | C31 | C32 | N09 | 179.9° | 179.7° |
| C31 | C33 | C34 | H341 | 179.2° | 180.0° |
| C34 | C35 | N12 | C36 | 179.5° | 179.9° |
| C34 | C35 | N12 | C37 | 179.8° | 179.8° |
| C34 | C35 | C36 | C32 | 0.1° | 0.6° |
| C34 | C35 | C36 | N11 | 179.2° | 179.4° |
| C35 | C34 | C33 | H331 | 179.2° | 179.8° |
| C31 | N10 | C30 | C29 | 0.9° | 0.1° |
| N10 | C31 | C32 | C36 | 179.8° | 179.6° |
| N10 | C31 | C32 | N09 | 0.5° | 0.4° |
| C31 | N10 | C30 | H301 | 179.1° | 179.9° |
| N10 | C31 | C33 | H331 | 0.2° | 0.7° |
| C30 | N10 | C31 | C32 | 1.0° | 0.0° |
| N10 | C30 | C29 | H301 | 180.0° | 180.0° |
| N10 | C30 | C29 | N09 | 0.3° | 0.1° |
| N10 | C30 | C29 | H291 | 179.7° | 180.0° |
| C31 | C32 | C36 | C35 | 0.0° | 0.2° |
| C31 | C32 | C36 | N09 | 179.8° | 180.0° |
| C31 | C32 | C36 | N11 | 179.3° | 179.8° |
| C31 | C32 | N09 | C29 | 0.1° | 0.7° |
| C31 | C32 | N09 | RU1 | 179.4° | 179.0° |
| C32 | C31 | C33 | H331 | 179.3° | 179.4° |
| N12 | C35 | C36 | C32 | 179.6° | 179.5° |
| N12 | C35 | C36 | N11 | 0.3° | 0.6° |
| C35 | N12 | C37 | C38 | 0.5° | 0.3° |
| N12 | C35 | C34 | H341 | 0.0° | 0.5° |
| C35 | N12 | C37 | H371 | 179.5° | 179.9° |
| C36 | C35 | N12 | C37 | 0.7° | 0.1° |
| C35 | C36 | C32 | N11 | 179.3° | 180.0° |
| C35 | C36 | C32 | N09 | 179.8° | 179.8° |
| C35 | C36 | N11 | C38 | 1.5° | 0.6° |
| C35 | C36 | N11 | RU1 | 179.2° | 179.2° |
| C36 | C35 | C34 | H341 | 179.5° | 179.5° |
| N12 | C37 | C38 | H371 | 180.0° | 179.8° |
| N12 | C37 | C38 | N11 | 0.6° | 0.3° |
| N12 | C37 | C38 | H381 | 179.4° | 179.8° |
| C30 | C29 | N09 | C32 | 0.2° | 0.5° |
| C30 | C29 | N09 | H291 | 180.0° | 179.8° |
| C30 | C29 | N09 | RU1 | 179.2° | 179.1° |
| C36 | C32 | N09 | C29 | 179.6° | 179.3° |
| C36 | C32 | N09 | RU1 | 0.9° | 1.0° |
| C32 | C36 | N11 | C38 | 179.2° | 179.5° |
| C32 | C36 | N11 | RU1 | 1.5° | 0.7° |
| N09 | C32 | C36 | N11 | 0.5° | 0.2° |
| C32 | N09 | C29 | RU1 | 179.5° | 179.6° |
| C32 | N09 | RU1 | N11 | 1.3° | 1.1° |
| C32 | N09 | RU1 | N05 | 89.6° | 93.0° |
| C32 | N09 | RU1 | N03 | 93.0° | 90.2° |
| C32 | N09 | RU1 | N04 | 173.6° | 174.5° |
| C32 | N09 | RU1 | N08 | 20.6° | 52.2° |
| C32 | N09 | C29 | H291 | 179.8° | 179.6° |
| C36 | N11 | C38 | C37 | 1.7° | 0.1° |
| C36 | N11 | RU1 | N09 | 1.5° | 1.0° |
| C36 | N11 | C38 | RU1 | 177.2° | 179.8° |
| C36 | N11 | RU1 | N05 | 95.5° | 92.7° |
| C36 | N11 | RU1 | N03 | 93.6° | 88.5° |
| C36 | N11 | RU1 | N04 | 45.6° | 31.4° |
| C36 | N11 | RU1 | N08 | 179.5° | 177.1° |
| C36 | N11 | C38 | H381 | 178.3° | 179.8° |
| C37 | C38 | N11 | H381 | 180.0° | 179.9° |
| C37 | C38 | N11 | RU1 | 178.9° | 179.6° |
| C29 | N09 | RU1 | N11 | 179.2° | 179.3° |
| C29 | N09 | RU1 | N05 | 90.9° | 87.3° |
| C29 | N09 | RU1 | N03 | 86.5° | 89.4° |
| C29 | N09 | RU1 | N04 | 5.9° | 5.2° |
| C29 | N09 | RU1 | N08 | 159.9° | 128.2° |
| N09 | C29 | C30 | H301 | 179.7° | 179.9° |
| N09 | RU1 | N11 | C38 | 178.9° | 179.2° |
| N09 | RU1 | N11 | N05 | 94.0° | 91.7° |
| N09 | RU1 | N11 | N03 | 95.0° | 89.4° |
| N09 | RU1 | N11 | N04 | 47.1° | 32.3° |
| N09 | RU1 | N11 | N08 | 178.0° | 176.1° |
| N09 | RU1 | N05 | C19 | 5.7° | 3.8° |
| N09 | RU1 | N03 | C12 | 88.0° | 99.7° |
| N09 | RU1 | N05 | N03 | 164.9° | 114.3° |
| N09 | RU1 | N05 | N04 | 95.1° | 88.8° |
| N09 | RU1 | N05 | N08 | 174.4° | 176.7° |
| N09 | RU1 | N05 | C21 | 173.0° | 176.0° |
| N09 | RU1 | N03 | N04 | 93.7° | 88.8° |
| N09 | RU1 | N03 | N08 | 174.5° | 176.9° |
| N09 | RU1 | N04 | N08 | 178.5° | 176.4° |
| N09 | RU1 | N03 | C13 | 94.6° | 78.9° |
| N09 | RU1 | N04 | C16 | 82.8° | 98.2° |
| N09 | RU1 | N04 | C14 | 95.0° | 80.3° |
| N09 | RU1 | N08 | C28 | 67.6° | 40.4° |
| N09 | RU1 | N08 | C27 | 109.8° | 139.3° |
| RU1 | N09 | C29 | H291 | 0.8° | 0.7° |
| C38 | N11 | RU1 | N05 | 87.0° | 87.5° |
| C38 | N11 | RU1 | N03 | 83.9° | 91.3° |
| C38 | N11 | RU1 | N04 | 131.9° | 148.4° |
| C38 | N11 | RU1 | N08 | 3.1° | 3.1° |
| N11 | C38 | C37 | H371 | 179.3° | 179.9° |
| N11 | RU1 | N05 | C19 | 86.3° | 88.0° |
| N11 | RU1 | N03 | C12 | 6.9° | 15.6° |
| N11 | RU1 | N05 | N03 | 114.6° | 161.5° |
| N11 | RU1 | N05 | N04 | 175.6° | 173.0° |
| N11 | RU1 | N05 | N08 | 93.8° | 92.5° |
| N11 | RU1 | N05 | C21 | 92.4° | 91.8° |
| N11 | RU1 | N03 | N04 | 174.8° | 172.9° |
| N11 | RU1 | N03 | N08 | 93.4° | 92.8° |
| N11 | RU1 | N04 | N08 | 135.0° | 151.5° |
| N11 | RU1 | N03 | C13 | 175.7° | 163.0° |
| N11 | RU1 | N04 | C16 | 129.3° | 130.4° |
| N11 | RU1 | N04 | C14 | 48.6° | 48.2° |
| N11 | RU1 | N08 | C28 | 86.8° | 91.3° |
| N11 | RU1 | N08 | C27 | 90.7° | 88.5° |
| RU1 | N11 | C38 | H381 | 1.1° | 0.4° |
| C20 | C19 | N05 | H191 | 180.0° | 179.7° |
| C19 | C20 | N06 | H201 | 180.0° | 179.7° |
| C20 | C19 | N05 | RU1 | 179.0° | 180.0° |
| C20 | C19 | N05 | C21 | 0.5° | 0.2° |
| C19 | C20 | N06 | C22 | 0.4° | 0.1° |
| N05 | C19 | C20 | N06 | 0.1° | 0.4° |
| C19 | N05 | RU1 | C21 | 178.7° | 179.8° |
| C19 | N05 | RU1 | N03 | 159.1° | 110.5° |
| C19 | N05 | RU1 | N04 | 89.3° | 85.1° |
| C19 | N05 | RU1 | N08 | 179.9° | 179.5° |
| C19 | N05 | C21 | C22 | 0.3° | 0.2° |
| C19 | N05 | C21 | C28 | 179.7° | 179.6° |
| N05 | C19 | C20 | H201 | 179.9° | 179.9° |
| C20 | N06 | C22 | C21 | 0.5° | 0.4° |
| C20 | N06 | C22 | C23 | 179.8° | 179.8° |
| N06 | C20 | C19 | H191 | 179.9° | 179.9° |
| C11 | C12 | N03 | H121 | 180.0° | 179.9° |
| C11 | C12 | N03 | RU1 | 178.4° | 176.2° |
| C12 | C11 | C10 | H111 | 180.0° | 179.6° |
| C11 | C12 | N03 | C13 | 1.2° | 2.3° |
| C12 | C11 | C10 | C09 | 0.8° | 1.6° |
| C12 | C11 | C10 | H101 | 179.2° | 178.6° |
| C12 | N03 | RU1 | N05 | 107.2° | 145.9° |
| C12 | N03 | RU1 | C13 | 177.4° | 178.6° |
| C12 | N03 | RU1 | N04 | 178.3° | 171.5° |
| C12 | N03 | RU1 | N08 | 86.5° | 77.2° |
| N03 | C12 | C11 | C10 | 0.0° | 1.9° |
| C12 | N03 | C13 | C09 | 1.7° | 6.5° |
| C12 | N03 | C13 | C14 | 179.3° | 172.3° |
| N03 | C12 | C11 | H111 | 179.9° | 178.5° |
| N05 | RU1 | N03 | N04 | 71.1° | 25.6° |
| N05 | RU1 | N03 | N08 | 20.7° | 68.7° |
| N05 | RU1 | N04 | N08 | 84.2° | 84.5° |
| N05 | RU1 | N03 | C13 | 70.2° | 35.5° |
| RU1 | N05 | C21 | C22 | 179.2° | 179.6° |
| RU1 | N05 | C21 | C28 | 0.9° | 0.6° |
| N05 | RU1 | N04 | C16 | 11.5° | 6.3° |
| N05 | RU1 | N04 | C14 | 170.6° | 172.2° |
| N05 | RU1 | N08 | C28 | 1.8° | 0.7° |
| N05 | RU1 | N08 | C27 | 179.2° | 179.6° |
| RU1 | N05 | C19 | H191 | 1.0° | 0.3° |
| C21 | N05 | RU1 | N03 | 22.2° | 69.6° |
| C21 | N05 | RU1 | N04 | 92.0° | 95.1° |
| C21 | N05 | RU1 | N08 | 1.4° | 0.7° |
| N05 | C21 | C22 | N06 | 0.2° | 0.5° |
| N05 | C21 | C22 | C28 | 179.9° | 179.8° |
| N05 | C21 | C22 | C23 | 179.9° | 179.6° |
| N05 | C21 | C28 | N08 | 0.7° | 0.0° |
| N05 | C21 | C28 | C25 | 179.6° | 179.9° |
| C21 | N05 | C19 | H191 | 179.5° | 179.9° |
| N03 | RU1 | N04 | N08 | 86.4° | 94.0° |
| RU1 | N03 | C13 | C09 | 179.2° | 172.2° |
| RU1 | N03 | C13 | C14 | 1.8° | 8.9° |
| N03 | RU1 | N04 | C16 | 178.0° | 172.1° |
| N03 | RU1 | N04 | C14 | 0.1° | 9.3° |
| N03 | RU1 | N08 | C28 | 178.2° | 177.3° |
| N03 | RU1 | N08 | C27 | 4.3° | 3.0° |
| RU1 | N03 | C12 | H121 | 1.6° | 3.9° |
| N04 | RU1 | N03 | C13 | 0.9° | 9.9° |
| RU1 | N04 | C14 | C13 | 1.1° | 7.4° |
| RU1 | N04 | C16 | C14 | 177.7° | 178.4° |
| RU1 | N04 | C16 | C17 | 179.6° | 176.2° |
| N04 | RU1 | N08 | C28 | 98.1° | 92.7° |
| N04 | RU1 | N08 | C27 | 84.4° | 87.5° |
| RU1 | N04 | C14 | C15 | 179.9° | 171.3° |
| RU1 | N04 | C16 | H161 | 0.4° | 4.9° |
| N08 | RU1 | N03 | C13 | 90.9° | 104.2° |
| RU1 | N08 | C28 | C21 | 1.8° | 0.6° |
| N08 | RU1 | N04 | C16 | 95.7° | 78.1° |
| N08 | RU1 | N04 | C14 | 86.5° | 103.3° |
| RU1 | N08 | C28 | C27 | 177.7° | 179.8° |
| RU1 | N08 | C28 | C25 | 179.2° | 179.3° |
| RU1 | N08 | C27 | C26 | 178.4° | 179.4° |
| RU1 | N08 | C27 | H271 | 1.6° | 0.6° |
| C11 | C10 | C09 | H101 | 180.0° | 179.8° |
| C11 | C10 | C09 | C13 | 0.3° | 2.5° |
| C11 | C10 | C09 | C07 | 179.9° | 175.3° |
| C10 | C11 | C12 | H121 | 180.0° | 178.2° |
| N06 | C22 | C21 | C23 | 179.7° | 179.8° |
| N06 | C22 | C21 | C28 | 179.8° | 179.3° |
| N06 | C22 | C23 | C24 | 179.6° | 179.5° |
| C22 | N06 | C20 | H201 | 179.6° | 179.8° |
| N06 | C22 | C23 | H231 | 0.4° | 0.5° |
| N03 | C13 | C09 | C10 | 0.9° | 6.6° |
| N03 | C13 | C09 | C14 | 178.9° | 178.8° |
| N03 | C13 | C14 | N04 | 2.0° | 1.1° |
| N03 | C13 | C09 | C07 | 178.9° | 171.3° |
| N03 | C13 | C14 | C15 | 179.1° | 179.8° |
| C13 | N03 | C12 | H121 | 178.8° | 177.6° |
| C22 | C21 | C28 | N08 | 179.3° | 179.8° |
| C22 | C21 | C28 | C25 | 0.3° | 0.3° |
| C21 | C22 | C23 | C24 | 0.1° | 0.4° |
| C21 | C22 | C23 | H231 | 179.9° | 179.6° |
| C28 | C21 | C22 | C23 | 0.0° | 0.6° |
| C21 | C28 | N08 | C25 | 178.9° | 179.9° |
| C21 | C28 | N08 | C27 | 179.5° | 179.7° |
| C21 | C28 | C25 | C24 | 0.5° | 0.2° |
| C21 | C28 | C25 | N07 | 179.8° | 179.8° |
| C10 | C09 | C13 | C07 | 179.8° | 177.8° |
| C10 | C09 | C13 | C14 | 179.8° | 172.2° |
| C10 | C09 | C07 | N01 | 0.3° | 8.9° |
| C10 | C09 | C07 | C08 | 179.8° | 172.1° |
| C09 | C10 | C11 | H111 | 179.2° | 178.8° |
| C22 | C23 | C24 | H231 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.1° | 0.1° |
| C22 | C23 | C24 | H241 | 179.9° | 180.0° |
| C09 | C13 | C14 | N04 | 179.1° | 179.9° |
| C09 | C13 | C14 | C15 | 0.2° | 1.3° |
| C13 | C09 | C07 | N01 | 180.0° | 168.9° |
| C13 | C09 | C07 | C08 | 0.4° | 10.1° |
| C13 | C09 | C10 | H101 | 179.6° | 177.4° |
| C13 | C14 | N04 | C16 | 179.1° | 173.9° |
| C13 | C14 | N04 | C15 | 178.8° | 178.7° |
| C14 | C13 | C09 | C07 | 0.0° | 9.9° |
| C13 | C14 | C15 | C18 | 180.0° | 174.1° |
| C13 | C14 | C15 | C08 | 0.1° | 7.0° |
| N04 | C16 | C17 | H161 | 180.0° | 178.9° |
| C16 | N04 | C14 | C15 | 2.1° | 7.4° |
| N04 | C16 | C17 | C18 | 1.0° | 3.1° |
| N04 | C16 | C17 | H171 | 178.9° | 177.4° |
| C14 | N04 | C16 | C17 | 1.9° | 2.2° |
| N04 | C14 | C15 | C18 | 1.2° | 7.2° |
| N04 | C14 | C15 | C08 | 178.9° | 171.8° |
| C14 | N04 | C16 | H161 | 178.1° | 176.7° |
| C16 | C17 | C18 | H171 | 180.0° | 179.5° |
| C16 | C17 | C18 | C15 | 0.2° | 3.0° |
| C16 | C17 | C18 | H181 | 179.8° | 177.6° |
| C09 | C07 | N01 | C08 | 179.6° | 179.0° |
| C09 | C07 | C08 | C15 | 0.5° | 1.9° |
| C09 | C07 | N01 | C05 | 179.8° | 175.9° |
| C09 | C07 | C08 | N02 | 179.8° | 179.8° |
| C07 | C09 | C10 | H101 | 0.1° | 4.9° |
| C28 | N08 | C27 | C26 | 1.3° | 0.3° |
| N08 | C28 | C25 | C24 | 179.4° | 179.7° |
| N08 | C28 | C25 | N07 | 1.2° | 0.3° |
| C28 | N08 | C27 | H271 | 178.7° | 179.7° |
| C27 | N08 | C28 | C25 | 1.5° | 0.4° |
| N08 | C27 | C26 | H271 | 180.0° | 180.0° |
| N08 | C27 | C26 | N07 | 0.8° | 0.0° |
| N08 | C27 | C26 | H261 | 179.2° | 180.0° |
| C14 | C15 | C18 | C17 | 0.3° | 1.9° |
| C14 | C15 | C08 | C07 | 0.3° | 6.6° |
| C14 | C15 | C18 | C08 | 179.9° | 178.9° |
| C14 | C15 | C08 | N02 | 179.5° | 171.3° |
| C14 | C15 | C18 | H181 | 179.7° | 177.5° |
| C28 | C25 | C24 | C23 | 0.4° | 0.4° |
| C28 | C25 | C24 | N07 | 179.4° | 180.0° |
| C28 | C25 | N07 | C26 | 0.7° | 0.0° |
| C28 | C25 | C24 | H241 | 179.7° | 179.7° |
| C23 | C24 | C25 | H241 | 180.0° | 179.9° |
| C23 | C24 | C25 | N07 | 179.7° | 179.6° |
| C17 | C18 | C15 | H181 | 180.0° | 179.4° |
| C17 | C18 | C15 | C08 | 179.8° | 177.0° |
| C18 | C17 | C16 | H161 | 179.0° | 178.0° |
| N01 | C07 | C08 | C15 | 179.9° | 177.1° |
| N01 | C07 | C08 | N02 | 0.6° | 0.7° |
| C07 | N01 | C05 | C04 | 179.8° | 175.3° |
| C07 | N01 | C05 | C06 | 0.0° | 4.0° |
| C07 | C08 | C15 | C18 | 179.6° | 174.5° |
| C07 | C08 | C15 | N02 | 179.2° | 177.9° |
| C08 | C07 | N01 | C05 | 0.2° | 3.1° |
| C07 | C08 | N02 | C06 | 0.9° | 3.5° |
| C27 | C26 | N07 | C25 | 0.5° | 0.1° |
| C27 | C26 | N07 | H261 | 180.0° | 179.9° |
| C18 | C15 | C08 | N02 | 0.4° | 7.7° |
| C15 | C18 | C17 | H171 | 179.7° | 177.5° |
| C15 | C08 | N02 | C06 | 179.8° | 174.4° |
| C08 | C15 | C18 | H181 | 0.2° | 3.6° |
| N01 | C05 | C04 | C06 | 179.8° | 179.3° |
| N01 | C05 | C06 | N02 | 0.3° | 1.3° |
| N01 | C05 | C04 | C01 | 179.8° | 178.0° |
| N01 | C05 | C06 | C03 | 179.9° | 179.7° |
| N01 | C05 | C04 | H041 | 0.1° | 1.2° |
| C24 | C25 | N07 | C26 | 179.9° | 180.0° |
| C25 | C24 | C23 | H231 | 180.0° | 179.8° |
| N07 | C25 | C24 | H241 | 0.3° | 0.3° |
| C25 | N07 | C26 | H261 | 179.5° | 179.9° |
| C08 | N02 | C06 | C05 | 0.8° | 2.5° |
| C08 | N02 | C06 | C03 | 179.6° | 176.5° |
| N07 | C26 | C27 | H271 | 179.3° | 180.0° |
| C04 | C05 | C06 | N02 | 179.9° | 178.0° |
| C05 | C04 | C01 | H041 | 180.0° | 179.2° |
| C04 | C05 | C06 | C03 | 0.3° | 0.9° |
| C05 | C04 | C01 | C02 | 0.2° | 2.3° |
| C05 | C04 | C01 | BR1 | 179.6° | 177.6° |
| C05 | C06 | N02 | C03 | 179.6° | 178.9° |
| C06 | C05 | C04 | C01 | 0.3° | 1.4° |
| C05 | C06 | C03 | C02 | 0.1° | 2.4° |
| C05 | C06 | C03 | H031 | 179.9° | 178.2° |
| C06 | C05 | C04 | H041 | 179.7° | 179.4° |
| N02 | C06 | C03 | C02 | 179.7° | 176.6° |
| N02 | C06 | C03 | H031 | 0.3° | 2.9° |
| C04 | C01 | C02 | BR1 | 179.8° | 179.9° |
| C04 | C01 | C02 | C03 | 0.1° | 0.8° |
| C04 | C01 | C02 | H021 | 179.9° | 179.9° |
| C06 | C03 | C02 | C01 | 0.0° | 1.6° |
| C06 | C03 | C02 | H031 | 180.0° | 179.5° |
| C06 | C03 | C02 | H021 | 180.0° | 177.7° |
| C01 | C02 | C03 | H021 | 180.0° | 179.3° |
| C01 | C02 | C03 | H031 | 180.0° | 178.9° |
| C02 | C01 | C04 | H041 | 179.8° | 178.5° |
| BR1 | C01 | C02 | C03 | 179.8° | 179.1° |
| BR1 | C01 | C02 | H021 | 0.2° | 0.2° |
| BR1 | C01 | C04 | H041 | 0.4° | 1.6° |
| H171 | C17 | C18 | H181 | 0.3° | 1.9° |
| H171 | C17 | C16 | H161 | 1.1° | 1.5° |
| H191 | C19 | C20 | H201 | 0.1° | 0.2° |
| H241 | C24 | C23 | H231 | 0.0° | 0.1° |
| H111 | C11 | C10 | H101 | 0.9° | 1.0° |
| H111 | C11 | C12 | H121 | 0.1° | 1.4° |
| H261 | C26 | C27 | H271 | 0.8° | 0.1° |
| H291 | C29 | C30 | H301 | 0.3° | 0.0° |
| H021 | C02 | C03 | H031 | 0.0° | 1.8° |
| H331 | C33 | C34 | H341 | 0.8° | 0.2° |
| H371 | C37 | C38 | H381 | 0.6° | 0.1° |
