YN7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C43 | C44 | sing | 1.54Å | 1.32Å | |
| C43 | C42 | sing | 1.54Å | 1.66Å | |
| C44 | N01 | sing | 1.47Å | 1.54Å | |
| C42 | C41 | sing | 1.52Å | 1.32Å | |
| N01 | C41 | sing | 1.36Å | 1.49Å | |
| N01 | C02 | sing | 1.36Å | 1.39Å | |
| C41 | N45 | doub | 1.31Å | 1.40Å | |
| O03 | C02 | doub | 1.22Å | 1.20Å | |
| C02 | C04 | sing | 1.41Å | 1.53Å | |
| N45 | C40 | sing | 1.34Å | 1.46Å | |
| O15 | C14 | doub | 1.22Å | 1.18Å | |
| C31 | N30 | sing | 1.47Å | 1.32Å | |
| C28 | C27 | sing | 1.53Å | 1.57Å | |
| C04 | C40 | doub | 1.40Å | 1.45Å | Aromatic |
| C04 | C05 | sing | 1.47Å | 1.41Å | Aromatic |
| C29 | N30 | sing | 1.47Å | 1.38Å | |
| C29 | C27 | sing | 1.53Å | 1.50Å | |
| C40 | N19 | sing | 1.36Å | 1.30Å | Aromatic |
| N30 | C32 | sing | 1.47Å | 1.37Å | |
| C14 | N16 | sing | 1.35Å | 1.39Å | |
| C14 | C13 | sing | 1.47Å | 1.53Å | |
| C27 | N26 | sing | 1.47Å | 1.46Å | |
| C17 | C13 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C06 | sing | 1.39Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.48Å | 1.41Å | |
| C05 | C18 | doub | 1.36Å | 1.41Å | Aromatic |
| N19 | C20 | sing | 1.46Å | 1.46Å | |
| N19 | C18 | sing | 1.37Å | 1.36Å | Aromatic |
| C13 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C32 | C33 | sing | 1.53Å | 1.48Å | |
| C06 | C07 | doub | 1.40Å | 1.41Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.48Å | |
| O39 | C21 | doub | 1.21Å | 1.20Å | |
| N26 | C33 | sing | 1.47Å | 1.45Å | |
| N26 | C25 | sing | 1.39Å | 1.45Å | |
| C21 | N22 | sing | 1.35Å | 1.42Å | |
| C24 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C11 | O12 | sing | 1.36Å | 1.41Å | |
| C11 | C09 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | N34 | sing | 1.33Å | 1.32Å | Aromatic |
| C07 | C09 | sing | 1.38Å | 1.36Å | Aromatic |
| C07 | F08 | sing | 1.35Å | 1.38Å | |
| N22 | C23 | sing | 1.40Å | 1.45Å | |
| C23 | C37 | doub | 1.40Å | 1.37Å | Aromatic |
| C09 | F10 | sing | 1.35Å | 1.36Å | |
| N34 | C35 | doub | 1.32Å | 1.32Å | Aromatic |
| C37 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | CL38 | sing | 1.74Å | 1.76Å | |
| C35 | F36 | sing | 1.35Å | 1.35Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H313 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C43 | H431 | sing | 1.09Å | 1.10Å | |
| C43 | H432 | sing | 1.09Å | 1.10Å | |
| C44 | H442 | sing | 1.09Å | 1.10Å | |
| C44 | H441 | sing | 1.09Å | 1.10Å | |
| N16 | H161 | sing | 0.97Å | 1.00Å | |
| N16 | H162 | sing | 0.97Å | 1.00Å | |
| N22 | H221 | sing | 0.97Å | 1.00Å | |
| O12 | H121 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C44 | C43 | C42 | 107.8° | 101.8° |
| C43 | C44 | N01 | 106.9° | 105.6° |
| C44 | C43 | H431 | 109.9° | 110.9° |
| C44 | C43 | H432 | 109.9° | 110.9° |
| C43 | C44 | H442 | 110.1° | 110.3° |
| C43 | C44 | H441 | 110.1° | 110.2° |
| C43 | C42 | C41 | 104.2° | 104.4° |
| C43 | C42 | H421 | 110.8° | 110.5° |
| C43 | C42 | H422 | 110.8° | 110.6° |
| C42 | C43 | H431 | 109.9° | 111.0° |
| C42 | C43 | H432 | 109.9° | 110.9° |
| C44 | N01 | C41 | 106.2° | 111.0° |
| C44 | N01 | C02 | 125.7° | 128.9° |
| N01 | C44 | H442 | 110.1° | 110.2° |
| N01 | C44 | H441 | 110.1° | 110.2° |
| C42 | C41 | N01 | 111.8° | 109.6° |
| C42 | C41 | N45 | 129.8° | 128.7° |
| C41 | C42 | H421 | 110.8° | 110.5° |
| C41 | C42 | H422 | 110.8° | 110.4° |
| C41 | N01 | C02 | 128.1° | 120.1° |
| N01 | C41 | N45 | 118.4° | 121.7° |
| N01 | C02 | O03 | 122.1° | 120.7° |
| N01 | C02 | C04 | 112.7° | 118.6° |
| C41 | N45 | C40 | 117.3° | 122.0° |
| O03 | C02 | C04 | 125.2° | 120.7° |
| C02 | C04 | C40 | 119.0° | 118.8° |
| C02 | C04 | C05 | 136.0° | 134.9° |
| N45 | C40 | C04 | 124.3° | 118.8° |
| N45 | C40 | N19 | 126.3° | 133.7° |
| O15 | C14 | N16 | 121.6° | 120.0° |
| O15 | C14 | C13 | 122.0° | 120.0° |
| C31 | N30 | C29 | 114.3° | 111.0° |
| C31 | N30 | C32 | 113.0° | 111.0° |
| N30 | C31 | H312 | 109.5° | 109.4° |
| N30 | C31 | H311 | 109.5° | 109.5° |
| N30 | C31 | H313 | 109.4° | 109.5° |
| C28 | C27 | C29 | 109.3° | 109.5° |
| C28 | C27 | N26 | 113.7° | 109.4° |
| C28 | C27 | H271 | 106.4° | 109.5° |
| C27 | C28 | H283 | 109.5° | 109.5° |
| C27 | C28 | H281 | 109.5° | 109.4° |
| C27 | C28 | H282 | 109.4° | 109.4° |
| C40 | C04 | C05 | 104.9° | 106.3° |
| C04 | C40 | N19 | 109.4° | 107.5° |
| C04 | C05 | C06 | 132.6° | 126.8° |
| C04 | C05 | C18 | 106.4° | 106.4° |
| N30 | C29 | C27 | 114.4° | 109.4° |
| C29 | N30 | C32 | 118.9° | 110.8° |
| N30 | C29 | H292 | 108.3° | 109.5° |
| N30 | C29 | H291 | 108.2° | 109.5° |
| C29 | C27 | N26 | 112.4° | 109.3° |
| C29 | C27 | H271 | 107.1° | 109.5° |
| C27 | C29 | H292 | 108.2° | 109.5° |
| C27 | C29 | H291 | 108.2° | 109.4° |
| C40 | N19 | C20 | 124.3° | 124.8° |
| C40 | N19 | C18 | 110.7° | 110.4° |
| N30 | C32 | C33 | 116.3° | 109.4° |
| N30 | C32 | H322 | 107.7° | 109.5° |
| N30 | C32 | H321 | 107.7° | 109.5° |
| N16 | C14 | C13 | 116.1° | 120.0° |
| C14 | N16 | H161 | 120.0° | 120.0° |
| C14 | N16 | H162 | 120.0° | 120.0° |
| C14 | C13 | C17 | 117.4° | 120.1° |
| C14 | C13 | C11 | 122.1° | 120.1° |
| C27 | N26 | C33 | 119.1° | 110.9° |
| C27 | N26 | C25 | 120.5° | 111.0° |
| N26 | C27 | H271 | 107.6° | 109.5° |
| C13 | C17 | C06 | 120.7° | 119.8° |
| C17 | C13 | C11 | 120.5° | 119.8° |
| C13 | C17 | H171 | 119.6° | 120.0° |
| C17 | C06 | C05 | 122.0° | 120.0° |
| C17 | C06 | C07 | 117.7° | 120.1° |
| C06 | C17 | H171 | 119.6° | 120.1° |
| C06 | C05 | C18 | 120.9° | 126.8° |
| C05 | C06 | C07 | 120.3° | 120.0° |
| C05 | C18 | N19 | 108.6° | 109.4° |
| C05 | C18 | H181 | 125.7° | 125.3° |
| C20 | N19 | C18 | 125.1° | 124.8° |
| N19 | C20 | C21 | 113.2° | 109.5° |
| N19 | C20 | H202 | 108.5° | 109.5° |
| N19 | C20 | H201 | 108.6° | 109.5° |
| N19 | C18 | H181 | 125.7° | 125.3° |
| C13 | C11 | O12 | 124.1° | 120.0° |
| C13 | C11 | C09 | 119.1° | 120.0° |
| C32 | C33 | N26 | 116.6° | 109.4° |
| C33 | C32 | H322 | 107.7° | 109.5° |
| C33 | C32 | H321 | 107.8° | 109.5° |
| C32 | C33 | H332 | 107.6° | 109.5° |
| C32 | C33 | H331 | 107.7° | 109.5° |
| C06 | C07 | C09 | 121.9° | 120.2° |
| C06 | C07 | F08 | 122.3° | 119.9° |
| C20 | C21 | O39 | 125.5° | 120.0° |
| C20 | C21 | N22 | 108.6° | 120.0° |
| C21 | C20 | H202 | 108.5° | 109.5° |
| C21 | C20 | H201 | 108.6° | 109.4° |
| O39 | C21 | N22 | 125.8° | 120.0° |
| C33 | N26 | C25 | 118.2° | 111.1° |
| N26 | C33 | H332 | 107.7° | 109.4° |
| N26 | C33 | H331 | 107.6° | 109.5° |
| N26 | C25 | C24 | 118.3° | 119.6° |
| N26 | C25 | N34 | 118.1° | 119.7° |
| C21 | N22 | C23 | 121.9° | 120.0° |
| C21 | N22 | H221 | 119.0° | 120.0° |
| C25 | C24 | C23 | 116.4° | 119.1° |
| C24 | C25 | N34 | 123.6° | 120.7° |
| C25 | C24 | H241 | 121.8° | 120.5° |
| C24 | C23 | N22 | 119.3° | 120.8° |
| C24 | C23 | C37 | 120.8° | 118.3° |
| C23 | C24 | H241 | 121.8° | 120.4° |
| O12 | C11 | C09 | 116.8° | 120.0° |
| C11 | O12 | H121 | 109.5° | 114.0° |
| C11 | C09 | C07 | 120.1° | 120.2° |
| C11 | C09 | F10 | 120.1° | 119.9° |
| C25 | N34 | C35 | 118.6° | 121.8° |
| C09 | C07 | F08 | 115.8° | 119.9° |
| C07 | C09 | F10 | 119.8° | 119.9° |
| N22 | C23 | C37 | 119.6° | 120.8° |
| C23 | N22 | H221 | 119.0° | 120.0° |
| C23 | C37 | C35 | 116.8° | 119.2° |
| C23 | C37 | CL38 | 121.0° | 120.4° |
| N34 | C35 | C37 | 123.8° | 120.9° |
| N34 | C35 | F36 | 117.6° | 119.6° |
| C35 | C37 | CL38 | 122.2° | 120.4° |
| C37 | C35 | F36 | 118.6° | 119.6° |
| H202 | C20 | H201 | 109.4° | 109.5° |
| H283 | C28 | H281 | 109.5° | 109.5° |
| H283 | C28 | H282 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.4° |
| H292 | C29 | H291 | 109.5° | 109.5° |
| H312 | C31 | H311 | 109.4° | 109.5° |
| H312 | C31 | H313 | 109.5° | 109.4° |
| H311 | C31 | H313 | 109.5° | 109.5° |
| H322 | C32 | H321 | 109.5° | 109.5° |
| H332 | C33 | H331 | 109.5° | 109.5° |
| H421 | C42 | H422 | 109.4° | 110.4° |
| H431 | C43 | H432 | 109.4° | 110.9° |
| H442 | C44 | H441 | 109.4° | 110.3° |
| H161 | N16 | H162 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C44 | C43 | C42 | H431 | 119.8° | 118.1° |
| C44 | C43 | C42 | H432 | 119.8° | 118.1° |
| C43 | C44 | N01 | H442 | 119.6° | 119.0° |
| C43 | C44 | N01 | H441 | 119.6° | 119.0° |
| C44 | C43 | C42 | C41 | 17.3° | 25.7° |
| C43 | C44 | N01 | C41 | 12.9° | 17.5° |
| C43 | C44 | N01 | C02 | 168.1° | 162.6° |
| C44 | C43 | C42 | H421 | 136.4° | 144.4° |
| C44 | C43 | C42 | H422 | 101.9° | 93.1° |
| C44 | C43 | H431 | H432 | 120.8° | 123.8° |
| C43 | C44 | H442 | H441 | 121.2° | 121.9° |
| C42 | C43 | C44 | N01 | 17.5° | 26.3° |
| C43 | C42 | C41 | H421 | 119.2° | 118.7° |
| C43 | C42 | C41 | H422 | 119.2° | 118.8° |
| C43 | C42 | C41 | N01 | 8.5° | 16.8° |
| C43 | C42 | C41 | N45 | 169.7° | 163.2° |
| C43 | C42 | H421 | H422 | 122.4° | 122.6° |
| C42 | C43 | H431 | H432 | 120.8° | 123.8° |
| C42 | C43 | C44 | H442 | 102.1° | 145.3° |
| C42 | C43 | C44 | H441 | 137.2° | 92.7° |
| C44 | N01 | C41 | C42 | 1.2° | 0.4° |
| C44 | N01 | C41 | C02 | 179.0° | 179.9° |
| C44 | N01 | C41 | N45 | 179.6° | 179.7° |
| C44 | N01 | C02 | O03 | 0.0° | 0.0° |
| C44 | N01 | C02 | C04 | 178.6° | 179.8° |
| N01 | C44 | C43 | H431 | 102.2° | 91.9° |
| N01 | C44 | C43 | H432 | 137.3° | 144.3° |
| N01 | C44 | H442 | H441 | 121.2° | 121.9° |
| C42 | C41 | N01 | N45 | 178.4° | 179.9° |
| C42 | C41 | N01 | C02 | 179.8° | 179.7° |
| C42 | C41 | N45 | C40 | 177.2° | 179.7° |
| C41 | C42 | H421 | H422 | 122.5° | 122.5° |
| C41 | C42 | C43 | H431 | 102.5° | 92.4° |
| C41 | C42 | C43 | H432 | 137.0° | 143.8° |
| C41 | N01 | C02 | O03 | 178.8° | 179.9° |
| C41 | N01 | C02 | C04 | 2.6° | 0.2° |
| N01 | C41 | N45 | C40 | 0.8° | 0.2° |
| N01 | C41 | C42 | H421 | 127.6° | 135.5° |
| N01 | C41 | C42 | H422 | 110.7° | 102.1° |
| C41 | N01 | C44 | H442 | 106.7° | 136.5° |
| C41 | N01 | C44 | H441 | 132.6° | 101.5° |
| C02 | N01 | C41 | N45 | 1.4° | 0.3° |
| N01 | C02 | O03 | C04 | 178.4° | 179.7° |
| N01 | C02 | C04 | C40 | 1.6° | 0.0° |
| N01 | C02 | C04 | C05 | 178.9° | 179.9° |
| C02 | N01 | C44 | H442 | 72.4° | 43.6° |
| C02 | N01 | C44 | H441 | 48.4° | 78.4° |
| C41 | N45 | C40 | C04 | 1.6° | 0.1° |
| C41 | N45 | C40 | N19 | 179.4° | 180.0° |
| N45 | C41 | C42 | H421 | 50.6° | 44.4° |
| N45 | C41 | C42 | H422 | 71.1° | 78.0° |
| O03 | C02 | C04 | C40 | 179.8° | 179.8° |
| O03 | C02 | C04 | C05 | 0.3° | 0.3° |
| C02 | C04 | C40 | N45 | 0.3° | 0.0° |
| C02 | C04 | C40 | C05 | 179.6° | 179.9° |
| C02 | C04 | C40 | N19 | 178.4° | 180.0° |
| C02 | C04 | C05 | C06 | 1.2° | 0.1° |
| C02 | C04 | C05 | C18 | 177.6° | 180.0° |
| N45 | C40 | C04 | N19 | 178.1° | 180.0° |
| N45 | C40 | C04 | C05 | 179.3° | 179.9° |
| N45 | C40 | N19 | C20 | 0.4° | 0.0° |
| N45 | C40 | N19 | C18 | 178.0° | 179.9° |
| O15 | C14 | N16 | C13 | 173.6° | 179.9° |
| O15 | C14 | C13 | C17 | 2.9° | 179.9° |
| O15 | C14 | C13 | C11 | 174.8° | 0.0° |
| O15 | C14 | N16 | H161 | 0.0° | 180.0° |
| O15 | C14 | N16 | H162 | 180.0° | 0.1° |
| C31 | N30 | C29 | C32 | 137.6° | 123.9° |
| C31 | N30 | C29 | C27 | 172.6° | 176.8° |
| C31 | N30 | C32 | C33 | 178.7° | 176.8° |
| C31 | N30 | C29 | H292 | 51.9° | 63.2° |
| C31 | N30 | C29 | H291 | 66.6° | 56.9° |
| N30 | C31 | H312 | H311 | 120.0° | 120.0° |
| N30 | C31 | H312 | H313 | 120.0° | 120.0° |
| N30 | C31 | H311 | H313 | 120.0° | 120.0° |
| C31 | N30 | C32 | H322 | 57.7° | 56.9° |
| C31 | N30 | C32 | H321 | 60.3° | 63.2° |
| C28 | C27 | C29 | N30 | 84.4° | 61.5° |
| C28 | C27 | C29 | N26 | 127.3° | 119.9° |
| C28 | C27 | C29 | H271 | 114.8° | 120.1° |
| C28 | C27 | N26 | H271 | 117.5° | 120.1° |
| C28 | C27 | N26 | C33 | 93.9° | 60.7° |
| C28 | C27 | N26 | C25 | 69.0° | 63.3° |
| C27 | C28 | H283 | H281 | 120.0° | 120.0° |
| C27 | C28 | H283 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H282 | 120.0° | 119.9° |
| C28 | C27 | C29 | H292 | 36.3° | 178.5° |
| C28 | C27 | C29 | H291 | 154.9° | 58.5° |
| C40 | C04 | C05 | C06 | 178.3° | 180.0° |
| C40 | C04 | C05 | C18 | 1.9° | 0.1° |
| C04 | C40 | N19 | C20 | 178.4° | 179.9° |
| C04 | C40 | N19 | C18 | 0.1° | 0.1° |
| C05 | C04 | C40 | N19 | 1.2° | 0.1° |
| C04 | C05 | C06 | C17 | 31.1° | 115.3° |
| C04 | C05 | C06 | C18 | 176.0° | 179.9° |
| C04 | C05 | C18 | N19 | 2.0° | 0.1° |
| C04 | C05 | C06 | C07 | 151.1° | 64.9° |
| C04 | C05 | C18 | H181 | 178.0° | 180.0° |
| N30 | C29 | C27 | H292 | 120.7° | 120.0° |
| N30 | C29 | C27 | H291 | 120.7° | 120.0° |
| N30 | C29 | C27 | N26 | 42.8° | 58.4° |
| C29 | N30 | C32 | C33 | 40.5° | 59.3° |
| N30 | C29 | C27 | H271 | 160.7° | 178.4° |
| N30 | C29 | H292 | H291 | 117.8° | 120.0° |
| C29 | N30 | C31 | H312 | 180.0° | 60.0° |
| C29 | N30 | C31 | H311 | 60.0° | 180.0° |
| C29 | N30 | C31 | H313 | 60.0° | 59.9° |
| C29 | N30 | C32 | H322 | 80.4° | 179.3° |
| C29 | N30 | C32 | H321 | 161.5° | 60.7° |
| C27 | C29 | N30 | C32 | 49.7° | 59.3° |
| C29 | C27 | N26 | H271 | 117.6° | 120.0° |
| C29 | C27 | N26 | C33 | 31.0° | 59.3° |
| C29 | C27 | N26 | C25 | 166.2° | 176.8° |
| C29 | C27 | C28 | H283 | 180.0° | 59.8° |
| C29 | C27 | C28 | H281 | 60.0° | 60.2° |
| C29 | C27 | C28 | H282 | 60.0° | 179.9° |
| C27 | C29 | H292 | H291 | 117.7° | 120.0° |
| C40 | N19 | C18 | C05 | 1.3° | 0.0° |
| C40 | N19 | C20 | C18 | 178.1° | 180.0° |
| C40 | N19 | C20 | C21 | 80.8° | 85.0° |
| C40 | N19 | C18 | H181 | 178.7° | 179.9° |
| C40 | N19 | C20 | H202 | 39.7° | 35.1° |
| C40 | N19 | C20 | H201 | 158.6° | 155.1° |
| N30 | C32 | C33 | H322 | 121.0° | 119.9° |
| N30 | C32 | C33 | H321 | 121.0° | 120.0° |
| N30 | C32 | C33 | N26 | 25.8° | 58.4° |
| C32 | N30 | C29 | H292 | 170.4° | 60.7° |
| C32 | N30 | C29 | H291 | 71.0° | 179.3° |
| C32 | N30 | C31 | H312 | 39.9° | 176.2° |
| C32 | N30 | C31 | H311 | 80.1° | 56.2° |
| C32 | N30 | C31 | H313 | 159.9° | 63.8° |
| N30 | C32 | H322 | H321 | 116.9° | 120.0° |
| N30 | C32 | C33 | H332 | 146.9° | 178.3° |
| N30 | C32 | C33 | H331 | 95.2° | 61.6° |
| N16 | C14 | C13 | C17 | 176.5° | 0.0° |
| N16 | C14 | C13 | C11 | 1.2° | 180.0° |
| C14 | N16 | H161 | H162 | 180.0° | 180.0° |
| C14 | C13 | C17 | C11 | 177.7° | 180.0° |
| C14 | C13 | C17 | C06 | 178.3° | 180.0° |
| C14 | C13 | C11 | O12 | 3.9° | 0.0° |
| C14 | C13 | C11 | C09 | 178.5° | 179.8° |
| C14 | C13 | C17 | H171 | 1.7° | 0.0° |
| C13 | C14 | N16 | H161 | 173.6° | 0.0° |
| C13 | C14 | N16 | H162 | 6.4° | 180.0° |
| C27 | N26 | C33 | C32 | 23.1° | 59.3° |
| C27 | N26 | C33 | C25 | 163.3° | 123.9° |
| C27 | N26 | C25 | C24 | 10.6° | 180.0° |
| C27 | N26 | C25 | N34 | 167.8° | 0.0° |
| N26 | C27 | C28 | H283 | 53.5° | 60.0° |
| N26 | C27 | C28 | H281 | 66.5° | 180.0° |
| N26 | C27 | C28 | H282 | 173.5° | 60.1° |
| N26 | C27 | C29 | H292 | 163.6° | 61.6° |
| N26 | C27 | C29 | H291 | 77.9° | 178.4° |
| C27 | N26 | C33 | H332 | 144.1° | 179.3° |
| C27 | N26 | C33 | H331 | 98.0° | 60.7° |
| C13 | C17 | C06 | H171 | 180.0° | 180.0° |
| C13 | C17 | C06 | C05 | 177.6° | 180.0° |
| C13 | C17 | C06 | C07 | 0.2° | 0.3° |
| C17 | C13 | C11 | O12 | 178.4° | 180.0° |
| C17 | C13 | C11 | C09 | 0.8° | 0.2° |
| C17 | C06 | C05 | C07 | 177.8° | 179.7° |
| C17 | C06 | C05 | C18 | 144.9° | 64.8° |
| C06 | C17 | C13 | C11 | 0.5° | 0.0° |
| C17 | C06 | C07 | C09 | 0.3° | 0.3° |
| C17 | C06 | C07 | F08 | 178.4° | 179.7° |
| C06 | C05 | C18 | N19 | 178.9° | 180.0° |
| C05 | C06 | C07 | C09 | 177.6° | 180.0° |
| C05 | C06 | C07 | F08 | 3.7° | 0.0° |
| C05 | C06 | C17 | H171 | 2.4° | 0.0° |
| C06 | C05 | C18 | H181 | 1.1° | 0.1° |
| C05 | C18 | N19 | C20 | 179.7° | 180.0° |
| C05 | C18 | N19 | H181 | 180.0° | 179.9° |
| C18 | C05 | C06 | C07 | 32.9° | 114.9° |
| N19 | C20 | C21 | H202 | 120.6° | 120.1° |
| N19 | C20 | C21 | H201 | 120.6° | 120.0° |
| N19 | C20 | C21 | O39 | 18.3° | 0.0° |
| N19 | C20 | C21 | N22 | 164.3° | 180.0° |
| C20 | N19 | C18 | H181 | 0.3° | 0.1° |
| N19 | C20 | H202 | H201 | 118.3° | 120.0° |
| C18 | N19 | C20 | C21 | 101.0° | 95.0° |
| C18 | N19 | C20 | H202 | 138.4° | 145.0° |
| C18 | N19 | C20 | H201 | 19.5° | 25.0° |
| C13 | C11 | O12 | C09 | 177.6° | 179.8° |
| C13 | C11 | C09 | C07 | 0.9° | 0.2° |
| C13 | C11 | C09 | F10 | 178.6° | 179.7° |
| C11 | C13 | C17 | H171 | 179.5° | 180.0° |
| C13 | C11 | O12 | H121 | 180.0° | 89.8° |
| C32 | C33 | N26 | H332 | 121.0° | 120.0° |
| C32 | C33 | N26 | H331 | 121.0° | 120.0° |
| C32 | C33 | N26 | C25 | 173.7° | 176.8° |
| C33 | C32 | H322 | H321 | 116.9° | 120.1° |
| C32 | C33 | H332 | H331 | 116.7° | 120.1° |
| C06 | C07 | C09 | C11 | 0.6° | 0.1° |
| C06 | C07 | C09 | F08 | 178.8° | 180.0° |
| C06 | C07 | C09 | F10 | 178.9° | 180.0° |
| C07 | C06 | C17 | H171 | 179.8° | 179.7° |
| C20 | C21 | O39 | N22 | 176.9° | 180.0° |
| C20 | C21 | N22 | C23 | 172.4° | 174.4° |
| C21 | C20 | H202 | H201 | 118.3° | 119.9° |
| C20 | C21 | N22 | H221 | 7.6° | 5.7° |
| O39 | C21 | N22 | C23 | 4.9° | 5.6° |
| O39 | C21 | C20 | H202 | 102.2° | 120.0° |
| O39 | C21 | C20 | H201 | 138.9° | 120.0° |
| O39 | C21 | N22 | H221 | 175.1° | 174.3° |
| C33 | N26 | C25 | C24 | 173.7° | 56.2° |
| C33 | N26 | C25 | N34 | 4.8° | 123.8° |
| C33 | N26 | C27 | H271 | 148.5° | 179.3° |
| N26 | C33 | C32 | H322 | 95.1° | 178.4° |
| N26 | C33 | C32 | H321 | 146.8° | 61.5° |
| N26 | C33 | H332 | H331 | 116.7° | 120.0° |
| N26 | C25 | C24 | N34 | 178.3° | 180.0° |
| N26 | C25 | C24 | C23 | 179.3° | 179.9° |
| N26 | C25 | N34 | C35 | 179.5° | 179.9° |
| N26 | C25 | C24 | H241 | 0.7° | 0.0° |
| C25 | N26 | C27 | H271 | 48.6° | 56.8° |
| C25 | N26 | C33 | H332 | 52.6° | 56.8° |
| C25 | N26 | C33 | H331 | 65.3° | 63.2° |
| C21 | N22 | C23 | C24 | 40.5° | 24.5° |
| C21 | N22 | C23 | H221 | 180.0° | 179.9° |
| C21 | N22 | C23 | C37 | 146.4° | 155.2° |
| N22 | C21 | C20 | H202 | 75.1° | 60.0° |
| N22 | C21 | C20 | H201 | 43.8° | 60.0° |
| C25 | C24 | C23 | H241 | 180.0° | 180.0° |
| C25 | C24 | C23 | N22 | 176.5° | 179.7° |
| C25 | C24 | C23 | C37 | 3.5° | 0.0° |
| C24 | C25 | N34 | C35 | 1.1° | 0.0° |
| C23 | C24 | C25 | N34 | 2.3° | 0.0° |
| C24 | C23 | N22 | C37 | 173.1° | 179.7° |
| C24 | C23 | C37 | C35 | 3.5° | 0.0° |
| C24 | C23 | C37 | CL38 | 175.5° | 179.9° |
| C24 | C23 | N22 | H221 | 139.5° | 155.5° |
| O12 | C11 | C09 | C07 | 178.6° | 180.0° |
| O12 | C11 | C09 | F10 | 0.9° | 0.0° |
| C11 | C09 | C07 | F10 | 179.5° | 179.9° |
| C11 | C09 | C07 | F08 | 178.2° | 179.9° |
| C09 | C11 | O12 | H121 | 2.4° | 90.0° |
| C25 | N34 | C35 | C37 | 1.1° | 0.0° |
| C25 | N34 | C35 | F36 | 179.7° | 180.0° |
| N34 | C25 | C24 | H241 | 177.6° | 180.0° |
| F08 | C07 | C09 | F10 | 2.3° | 0.0° |
| N22 | C23 | C37 | C35 | 176.5° | 179.7° |
| N22 | C23 | C37 | CL38 | 2.6° | 0.3° |
| N22 | C23 | C24 | H241 | 3.5° | 0.3° |
| C23 | C37 | C35 | N34 | 2.3° | 0.0° |
| C23 | C37 | C35 | CL38 | 179.1° | 180.0° |
| C23 | C37 | C35 | F36 | 179.1° | 180.0° |
| C37 | C23 | C24 | H241 | 176.4° | 180.0° |
| C37 | C23 | N22 | H221 | 33.6° | 24.8° |
| N34 | C35 | C37 | F36 | 178.6° | 180.0° |
| N34 | C35 | C37 | CL38 | 176.7° | 179.9° |
| CL38 | C37 | C35 | F36 | 1.8° | 0.0° |
| H271 | C27 | C28 | H283 | 64.7° | 180.0° |
| H271 | C27 | C28 | H281 | 175.3° | 59.9° |
| H271 | C27 | C28 | H282 | 55.3° | 60.0° |
| H271 | C27 | C29 | H292 | 78.5° | 58.3° |
| H271 | C27 | C29 | H291 | 40.0° | 61.7° |
| H283 | C28 | H281 | H282 | 120.0° | 120.1° |
| H312 | C31 | H311 | H313 | 120.0° | 120.0° |
| H322 | C32 | C33 | H332 | 25.9° | 61.7° |
| H322 | C32 | C33 | H331 | 143.8° | 58.4° |
| H321 | C32 | C33 | H332 | 92.1° | 58.4° |
| H321 | C32 | C33 | H331 | 25.8° | 178.4° |
| H421 | C42 | C43 | H431 | 16.7° | 26.3° |
| H421 | C42 | C43 | H432 | 103.8° | 97.5° |
| H422 | C42 | C43 | H431 | 138.3° | 148.8° |
| H422 | C42 | C43 | H432 | 17.8° | 25.0° |
| H431 | C43 | C44 | H442 | 138.1° | 27.1° |
| H431 | C43 | C44 | H441 | 17.4° | 149.1° |
| H432 | C43 | C44 | H442 | 17.6° | 96.7° |
| H432 | C43 | C44 | H441 | 103.1° | 25.3° |






