NF4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O40 | C38 | sing | 1.43Å | 1.39Å | |
| C38 | C39 | sing | 1.53Å | 1.52Å | |
| C38 | C01 | sing | 1.51Å | 1.52Å | |
| C01 | C02 | doub | 1.38Å | 1.50Å | Aromatic |
| C01 | C06 | sing | 1.38Å | 1.51Å | Aromatic |
| C13 | C42 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C02 | C03 | sing | 1.38Å | 1.52Å | Aromatic |
| C06 | C05 | doub | 1.38Å | 1.52Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | N10 | sing | 1.46Å | 1.47Å | |
| O17 | C16 | sing | 1.43Å | 1.39Å | |
| C03 | C04 | doub | 1.38Å | 1.52Å | Aromatic |
| C12 | C14 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | N10 | sing | 1.47Å | 1.48Å | |
| C05 | C04 | sing | 1.38Å | 1.51Å | Aromatic |
| C16 | C18 | sing | 1.53Å | 1.54Å | |
| N10 | S07 | sing | 1.66Å | 1.72Å | |
| C04 | S07 | sing | 1.76Å | 1.79Å | |
| C14 | C41 | sing | 1.53Å | 1.53Å | |
| S07 | O09 | doub | 1.42Å | 1.45Å | |
| S07 | O08 | doub | 1.42Å | 1.47Å | |
| C18 | C31 | sing | 1.53Å | 1.53Å | |
| C18 | N19 | sing | 1.47Å | 1.44Å | |
| C31 | C32 | sing | 1.51Å | 1.54Å | |
| N19 | C20 | sing | 1.35Å | 1.45Å | |
| C20 | O22 | sing | 1.35Å | 1.40Å | |
| C20 | O21 | doub | 1.22Å | 1.20Å | |
| C32 | C37 | doub | 1.38Å | 1.51Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.51Å | Aromatic |
| O22 | C23 | sing | 1.45Å | 1.50Å | |
| C37 | C36 | sing | 1.38Å | 1.52Å | Aromatic |
| C24 | O25 | sing | 1.44Å | 1.53Å | |
| C24 | C23 | sing | 1.54Å | 1.24Å | |
| C33 | C34 | doub | 1.38Å | 1.52Å | Aromatic |
| O25 | C27 | sing | 1.44Å | 1.52Å | |
| C23 | C26 | sing | 1.54Å | 1.63Å | |
| O30 | C29 | sing | 1.47Å | 1.48Å | |
| O30 | C27 | sing | 1.44Å | 1.57Å | |
| C29 | C28 | sing | 1.54Å | 1.33Å | |
| C36 | C35 | doub | 1.38Å | 1.51Å | Aromatic |
| C27 | C26 | sing | 1.56Å | 1.25Å | |
| C34 | C35 | sing | 1.38Å | 1.51Å | Aromatic |
| C28 | C26 | sing | 1.54Å | 1.63Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C39 | H391 | sing | 1.09Å | 1.10Å | |
| C39 | H392 | sing | 1.09Å | 1.10Å | |
| C39 | H393 | sing | 1.09Å | 1.10Å | |
| C41 | H411 | sing | 1.09Å | 1.10Å | |
| C41 | H412 | sing | 1.09Å | 1.10Å | |
| C41 | H413 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H423 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| N19 | H191 | sing | 0.97Å | 1.00Å | |
| O17 | H171 | sing | 0.97Å | 0.95Å | |
| O40 | H401 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O40 | C38 | C39 | 112.1° | 109.5° |
| O40 | C38 | C01 | 103.5° | 109.5° |
| O40 | C38 | H381 | 111.7° | 109.5° |
| C38 | O40 | H401 | 109.5° | 114.0° |
| C39 | C38 | C01 | 110.0° | 109.5° |
| C39 | C38 | H381 | 109.8° | 109.5° |
| C38 | C39 | H391 | 109.5° | 109.5° |
| C38 | C39 | H392 | 109.5° | 109.5° |
| C38 | C39 | H393 | 109.5° | 109.5° |
| C38 | C01 | C02 | 117.0° | 120.0° |
| C38 | C01 | C06 | 120.4° | 120.0° |
| C01 | C38 | H381 | 109.6° | 109.4° |
| C02 | C01 | C06 | 122.6° | 120.0° |
| C01 | C02 | C03 | 119.2° | 120.1° |
| C01 | C02 | H021 | 120.4° | 120.0° |
| C01 | C06 | C05 | 119.0° | 120.0° |
| C01 | C06 | H061 | 120.5° | 120.0° |
| C42 | C13 | C12 | 111.6° | 109.5° |
| C42 | C13 | H131 | 108.9° | 109.5° |
| C42 | C13 | H132 | 108.9° | 109.5° |
| C13 | C42 | H421 | 109.5° | 109.5° |
| C13 | C42 | H423 | 109.5° | 109.4° |
| C13 | C42 | H422 | 109.5° | 109.5° |
| C13 | C12 | C11 | 109.8° | 109.5° |
| C13 | C12 | C14 | 114.9° | 109.5° |
| C12 | C13 | H131 | 109.0° | 109.5° |
| C12 | C13 | H132 | 109.0° | 109.4° |
| C13 | C12 | H121 | 107.9° | 109.4° |
| C02 | C03 | C04 | 117.7° | 119.9° |
| C03 | C02 | H021 | 120.4° | 119.9° |
| C02 | C03 | H031 | 121.1° | 120.1° |
| C06 | C05 | C04 | 118.1° | 120.0° |
| C06 | C05 | H051 | 120.9° | 120.0° |
| C05 | C06 | H061 | 120.5° | 120.0° |
| C12 | C11 | N10 | 112.4° | 109.5° |
| C11 | C12 | C14 | 107.9° | 109.5° |
| C12 | C11 | H112 | 108.8° | 109.5° |
| C12 | C11 | H111 | 108.8° | 109.5° |
| C11 | C12 | H121 | 108.1° | 109.5° |
| C11 | N10 | C15 | 118.6° | 120.0° |
| C11 | N10 | S07 | 115.9° | 120.0° |
| N10 | C11 | H112 | 108.7° | 109.5° |
| N10 | C11 | H111 | 108.7° | 109.5° |
| O17 | C16 | C15 | 110.1° | 109.5° |
| O17 | C16 | C18 | 109.6° | 109.5° |
| O17 | C16 | H161 | 110.3° | 109.4° |
| C16 | O17 | H171 | 109.5° | 114.0° |
| C03 | C04 | C05 | 123.3° | 120.0° |
| C03 | C04 | S07 | 117.1° | 120.0° |
| C04 | C03 | H031 | 121.1° | 120.0° |
| C12 | C14 | C41 | 114.7° | 109.5° |
| C14 | C12 | H121 | 108.1° | 109.5° |
| C12 | C14 | H142 | 108.1° | 109.5° |
| C12 | C14 | H141 | 108.2° | 109.5° |
| C16 | C15 | N10 | 108.5° | 109.5° |
| C15 | C16 | C18 | 110.1° | 109.5° |
| C16 | C15 | H151 | 109.7° | 109.5° |
| C16 | C15 | H152 | 109.7° | 109.4° |
| C15 | C16 | H161 | 108.3° | 109.4° |
| C15 | N10 | S07 | 113.1° | 120.0° |
| N10 | C15 | H151 | 109.7° | 109.5° |
| N10 | C15 | H152 | 109.7° | 109.5° |
| C05 | C04 | S07 | 119.5° | 120.0° |
| C04 | C05 | H051 | 121.0° | 120.0° |
| C16 | C18 | C31 | 110.9° | 109.5° |
| C16 | C18 | N19 | 108.4° | 109.5° |
| C18 | C16 | H161 | 108.3° | 109.5° |
| C16 | C18 | H181 | 110.2° | 109.5° |
| N10 | S07 | C04 | 105.9° | 107.2° |
| N10 | S07 | O09 | 110.7° | 106.4° |
| N10 | S07 | O08 | 109.1° | 106.4° |
| C04 | S07 | O09 | 108.8° | 106.4° |
| C04 | S07 | O08 | 109.6° | 106.4° |
| C41 | C14 | H142 | 108.2° | 109.5° |
| C41 | C14 | H141 | 108.1° | 109.5° |
| C14 | C41 | H411 | 109.5° | 109.5° |
| C14 | C41 | H412 | 109.5° | 109.5° |
| C14 | C41 | H413 | 109.5° | 109.5° |
| O09 | S07 | O08 | 112.5° | 123.2° |
| C31 | C18 | N19 | 105.2° | 109.5° |
| C18 | C31 | C32 | 108.7° | 109.5° |
| C31 | C18 | H181 | 110.3° | 109.5° |
| C18 | C31 | H311 | 109.7° | 109.4° |
| C18 | C31 | H312 | 109.7° | 109.4° |
| C18 | N19 | C20 | 124.3° | 120.0° |
| N19 | C18 | H181 | 111.7° | 109.4° |
| C18 | N19 | H191 | 117.9° | 119.9° |
| C31 | C32 | C37 | 120.3° | 120.0° |
| C31 | C32 | C33 | 120.1° | 120.0° |
| C32 | C31 | H311 | 109.7° | 109.5° |
| C32 | C31 | H312 | 109.7° | 109.5° |
| N19 | C20 | O22 | 112.6° | 120.0° |
| N19 | C20 | O21 | 124.0° | 120.0° |
| C20 | N19 | H191 | 117.8° | 120.0° |
| O22 | C20 | O21 | 123.4° | 120.0° |
| C20 | O22 | C23 | 120.3° | 117.0° |
| C37 | C32 | C33 | 119.5° | 120.0° |
| C32 | C37 | C36 | 119.6° | 119.9° |
| C32 | C37 | H371 | 120.2° | 120.1° |
| C32 | C33 | C34 | 120.8° | 120.0° |
| C32 | C33 | H331 | 119.6° | 120.0° |
| O22 | C23 | C24 | 108.3° | 110.5° |
| O22 | C23 | C26 | 108.3° | 110.5° |
| O22 | C23 | H231 | 110.6° | 110.5° |
| C37 | C36 | C35 | 120.6° | 120.0° |
| C37 | C36 | H361 | 119.7° | 120.0° |
| C36 | C37 | H371 | 120.2° | 120.0° |
| O25 | C24 | C23 | 105.2° | 104.8° |
| C24 | O25 | C27 | 104.0° | 105.5° |
| O25 | C24 | H242 | 110.5° | 110.4° |
| O25 | C24 | H241 | 110.5° | 110.3° |
| C24 | C23 | C26 | 105.5° | 104.2° |
| C23 | C24 | H242 | 110.5° | 110.4° |
| C23 | C24 | H241 | 110.5° | 110.3° |
| C24 | C23 | H231 | 115.0° | 110.5° |
| C33 | C34 | C35 | 119.7° | 119.9° |
| C34 | C33 | H331 | 119.6° | 120.0° |
| C33 | C34 | H341 | 120.2° | 120.0° |
| O25 | C27 | O30 | 107.4° | 109.2° |
| O25 | C27 | C26 | 108.1° | 104.7° |
| O25 | C27 | H271 | 109.9° | 112.5° |
| C23 | C26 | C27 | 106.6° | 103.9° |
| C23 | C26 | C28 | 110.7° | 108.8° |
| C23 | C26 | H261 | 108.6° | 112.9° |
| C26 | C23 | H231 | 108.8° | 110.4° |
| C29 | O30 | C27 | 106.4° | 105.5° |
| O30 | C29 | C28 | 106.4° | 104.6° |
| O30 | C29 | H291 | 110.2° | 110.5° |
| O30 | C29 | H292 | 110.2° | 110.6° |
| O30 | C27 | C26 | 107.7° | 104.8° |
| O30 | C27 | H271 | 109.2° | 112.6° |
| C29 | C28 | C26 | 106.9° | 104.2° |
| C29 | C28 | H281 | 110.1° | 110.5° |
| C29 | C28 | H282 | 110.1° | 110.6° |
| C28 | C29 | H291 | 110.3° | 110.3° |
| C28 | C29 | H292 | 110.3° | 110.4° |
| C36 | C35 | C34 | 119.8° | 120.0° |
| C36 | C35 | H351 | 120.1° | 120.0° |
| C35 | C36 | H361 | 119.7° | 120.0° |
| C27 | C26 | C28 | 107.6° | 104.6° |
| C27 | C26 | H261 | 114.6° | 113.0° |
| C26 | C27 | H271 | 114.3° | 112.6° |
| C35 | C34 | H341 | 120.1° | 120.0° |
| C34 | C35 | H351 | 120.1° | 119.9° |
| C28 | C26 | H261 | 108.7° | 112.9° |
| C26 | C28 | H281 | 110.1° | 110.5° |
| C26 | C28 | H282 | 110.1° | 110.4° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H151 | C15 | H152 | 109.5° | 109.4° |
| H242 | C24 | H241 | 109.5° | 110.4° |
| H281 | C28 | H282 | 109.5° | 110.4° |
| H112 | C11 | H111 | 109.4° | 109.4° |
| H142 | C14 | H141 | 109.5° | 109.4° |
| H291 | C29 | H292 | 109.5° | 110.3° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| H391 | C39 | H392 | 109.5° | 109.4° |
| H391 | C39 | H393 | 109.4° | 109.5° |
| H392 | C39 | H393 | 109.4° | 109.4° |
| H411 | C41 | H412 | 109.4° | 109.4° |
| H411 | C41 | H413 | 109.5° | 109.5° |
| H412 | C41 | H413 | 109.5° | 109.5° |
| H421 | C42 | H423 | 109.5° | 109.5° |
| H421 | C42 | H422 | 109.5° | 109.5° |
| H423 | C42 | H422 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O40 | C38 | C39 | C01 | 114.6° | 120.0° |
| O40 | C38 | C39 | H381 | 124.7° | 120.0° |
| O40 | C38 | C01 | H381 | 119.3° | 120.0° |
| O40 | C38 | C01 | C02 | 89.1° | 145.0° |
| O40 | C38 | C01 | C06 | 89.5° | 35.3° |
| O40 | C38 | C39 | H391 | 180.0° | 180.0° |
| O40 | C38 | C39 | H392 | 60.0° | 60.0° |
| O40 | C38 | C39 | H393 | 60.0° | 60.0° |
| C39 | C38 | C01 | H381 | 120.8° | 120.0° |
| C39 | C38 | C01 | C02 | 151.0° | 95.0° |
| C39 | C38 | C01 | C06 | 30.4° | 84.7° |
| C38 | C39 | H391 | H392 | 120.0° | 120.0° |
| C38 | C39 | H391 | H393 | 120.0° | 120.1° |
| C38 | C39 | H392 | H393 | 120.0° | 120.0° |
| C39 | C38 | O40 | H401 | 180.0° | 60.0° |
| C38 | C01 | C02 | C06 | 178.6° | 179.7° |
| C38 | C01 | C02 | C03 | 178.4° | 179.7° |
| C38 | C01 | C06 | C05 | 179.5° | 179.7° |
| C38 | C01 | C02 | H021 | 1.7° | 0.4° |
| C38 | C01 | C06 | H061 | 0.5° | 0.3° |
| C01 | C38 | C39 | H391 | 65.4° | 60.0° |
| C01 | C38 | C39 | H392 | 174.6° | 180.0° |
| C01 | C38 | C39 | H393 | 54.6° | 60.1° |
| C01 | C38 | O40 | H401 | 61.5° | 60.0° |
| C01 | C02 | C03 | H021 | 180.0° | 179.9° |
| C02 | C01 | C06 | C05 | 0.9° | 0.1° |
| C01 | C02 | C03 | C04 | 1.3° | 0.0° |
| C01 | C02 | C03 | H031 | 178.7° | 180.0° |
| C02 | C01 | C06 | H061 | 179.1° | 180.0° |
| C02 | C01 | C38 | H381 | 30.2° | 25.0° |
| C06 | C01 | C02 | C03 | 0.3° | 0.0° |
| C01 | C06 | C05 | H061 | 180.0° | 179.9° |
| C01 | C06 | C05 | C04 | 0.9° | 0.1° |
| C06 | C01 | C02 | H021 | 179.7° | 180.0° |
| C01 | C06 | C05 | H051 | 179.1° | 180.0° |
| C06 | C01 | C38 | H381 | 151.2° | 155.3° |
| C42 | C13 | C12 | H131 | 120.3° | 120.0° |
| C42 | C13 | C12 | H132 | 120.3° | 120.0° |
| C42 | C13 | C12 | C11 | 60.3° | 67.3° |
| C42 | C13 | C12 | C14 | 61.4° | 172.7° |
| C42 | C13 | H131 | H132 | 119.0° | 120.0° |
| C42 | C13 | C12 | H121 | 177.8° | 52.7° |
| C13 | C42 | H421 | H423 | 120.0° | 120.0° |
| C13 | C42 | H421 | H422 | 120.0° | 120.0° |
| C13 | C42 | H423 | H422 | 120.0° | 120.0° |
| C13 | C12 | C11 | C14 | 125.8° | 120.0° |
| C13 | C12 | C11 | H121 | 117.5° | 120.0° |
| C13 | C12 | C11 | N10 | 178.8° | 66.1° |
| C13 | C12 | C14 | H121 | 120.6° | 120.0° |
| C13 | C12 | C14 | C41 | 53.5° | 175.9° |
| C12 | C13 | H131 | H132 | 119.1° | 120.0° |
| C13 | C12 | C11 | H112 | 58.4° | 173.9° |
| C13 | C12 | C11 | H111 | 60.7° | 53.9° |
| C13 | C12 | C14 | H142 | 174.2° | 64.1° |
| C13 | C12 | C14 | H141 | 67.3° | 55.8° |
| C12 | C13 | C42 | H421 | 180.0° | 59.0° |
| C12 | C13 | C42 | H423 | 60.0° | 179.0° |
| C12 | C13 | C42 | H422 | 60.0° | 61.0° |
| C02 | C03 | C04 | H031 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 1.3° | 0.1° |
| C02 | C03 | C04 | S07 | 179.6° | 180.0° |
| C06 | C05 | C04 | C03 | 0.2° | 0.1° |
| C06 | C05 | C04 | H051 | 180.0° | 179.9° |
| C06 | C05 | C04 | S07 | 178.4° | 179.9° |
| C12 | C11 | N10 | H112 | 120.5° | 120.0° |
| C12 | C11 | N10 | H111 | 120.5° | 120.0° |
| C11 | C12 | C14 | H121 | 116.6° | 120.0° |
| C12 | C11 | N10 | C15 | 90.9° | 84.6° |
| C12 | C11 | N10 | S07 | 129.5° | 95.3° |
| C11 | C12 | C14 | C41 | 176.2° | 64.1° |
| C11 | C12 | C13 | H131 | 179.4° | 172.7° |
| C11 | C12 | C13 | H132 | 60.0° | 52.7° |
| C12 | C11 | H112 | H111 | 118.7° | 120.0° |
| C11 | C12 | C14 | H142 | 63.0° | 55.9° |
| C11 | C12 | C14 | H141 | 55.5° | 175.9° |
| N10 | C11 | C12 | C14 | 55.3° | 54.0° |
| C11 | N10 | C15 | C16 | 105.5° | 75.5° |
| C11 | N10 | C15 | S07 | 140.7° | 179.9° |
| C11 | N10 | S07 | C04 | 52.1° | 91.2° |
| C11 | N10 | S07 | O09 | 169.8° | 22.3° |
| C11 | N10 | S07 | O08 | 65.8° | 155.3° |
| C11 | N10 | C15 | H151 | 134.6° | 44.6° |
| C11 | N10 | C15 | H152 | 14.3° | 164.5° |
| N10 | C11 | H112 | H111 | 118.7° | 120.0° |
| N10 | C11 | C12 | H121 | 61.4° | 174.0° |
| O17 | C16 | C15 | C18 | 121.1° | 120.1° |
| O17 | C16 | C15 | H161 | 120.7° | 119.9° |
| O17 | C16 | C15 | N10 | 164.3° | 66.3° |
| O17 | C16 | C18 | H161 | 120.3° | 120.0° |
| O17 | C16 | C18 | C31 | 50.1° | 55.0° |
| O17 | C16 | C18 | N19 | 64.9° | 65.0° |
| O17 | C16 | C15 | H151 | 75.8° | 173.7° |
| O17 | C16 | C15 | H152 | 44.5° | 53.7° |
| O17 | C16 | C18 | H181 | 172.6° | 175.0° |
| C03 | C04 | C05 | S07 | 178.2° | 180.0° |
| C03 | C04 | S07 | N10 | 80.2° | 82.0° |
| C03 | C04 | S07 | O09 | 38.8° | 31.6° |
| C03 | C04 | S07 | O08 | 162.2° | 164.5° |
| C04 | C03 | C02 | H021 | 178.6° | 180.0° |
| C03 | C04 | C05 | H051 | 179.8° | 180.0° |
| C12 | C14 | C41 | H142 | 120.7° | 120.0° |
| C12 | C14 | C41 | H141 | 120.8° | 120.1° |
| C14 | C12 | C13 | H131 | 58.9° | 52.6° |
| C14 | C12 | C13 | H132 | 178.2° | 67.3° |
| C14 | C12 | C11 | H112 | 175.8° | 66.0° |
| C14 | C12 | C11 | H111 | 65.1° | 174.0° |
| C12 | C14 | H142 | H141 | 117.6° | 120.0° |
| C12 | C14 | C41 | H411 | 180.0° | 176.3° |
| C12 | C14 | C41 | H412 | 60.0° | 56.3° |
| C12 | C14 | C41 | H413 | 60.0° | 63.7° |
| C16 | C15 | N10 | H151 | 119.8° | 120.1° |
| C16 | C15 | N10 | H152 | 119.8° | 120.0° |
| C15 | C16 | C18 | H161 | 118.3° | 119.9° |
| C16 | C15 | N10 | S07 | 113.7° | 104.6° |
| C15 | C16 | C18 | C31 | 71.2° | 65.0° |
| C15 | C16 | C18 | N19 | 173.8° | 175.0° |
| C16 | C15 | H151 | H152 | 120.4° | 120.0° |
| C15 | C16 | C18 | H181 | 51.3° | 55.0° |
| C15 | C16 | O17 | H171 | 180.0° | 65.2° |
| N10 | C15 | C16 | C18 | 74.6° | 173.6° |
| C15 | N10 | S07 | C04 | 89.7° | 88.9° |
| C15 | N10 | S07 | O09 | 28.0° | 157.6° |
| C15 | N10 | S07 | O08 | 152.3° | 24.7° |
| N10 | C15 | H151 | H152 | 120.5° | 120.0° |
| C15 | N10 | C11 | H112 | 29.5° | 35.4° |
| C15 | N10 | C11 | H111 | 148.6° | 155.3° |
| N10 | C15 | C16 | H161 | 43.6° | 53.6° |
| C05 | C04 | S07 | N10 | 98.2° | 98.0° |
| C05 | C04 | S07 | O09 | 142.8° | 148.4° |
| C05 | C04 | S07 | O08 | 19.5° | 15.5° |
| C05 | C04 | C03 | H031 | 178.7° | 180.0° |
| C04 | C05 | C06 | H061 | 179.1° | 180.0° |
| C16 | C18 | C31 | N19 | 117.0° | 120.0° |
| C16 | C18 | C31 | H181 | 122.4° | 120.0° |
| C16 | C18 | N19 | H181 | 121.6° | 120.0° |
| C16 | C18 | C31 | C32 | 176.3° | 175.0° |
| C16 | C18 | N19 | C20 | 109.3° | 155.0° |
| C18 | C16 | C15 | H151 | 45.2° | 53.6° |
| C18 | C16 | C15 | H152 | 165.5° | 66.4° |
| C16 | C18 | C31 | H311 | 56.4° | 65.0° |
| C16 | C18 | C31 | H312 | 63.9° | 55.0° |
| C16 | C18 | N19 | H191 | 70.7° | 25.0° |
| C18 | C16 | O17 | H171 | 58.6° | 54.8° |
| N10 | S07 | C04 | O09 | 119.0° | 113.5° |
| N10 | S07 | C04 | O08 | 117.6° | 113.5° |
| N10 | S07 | O09 | O08 | 122.4° | 123.0° |
| S07 | N10 | C15 | H151 | 6.1° | 135.4° |
| S07 | N10 | C15 | H152 | 126.4° | 15.4° |
| S07 | N10 | C11 | H112 | 110.1° | 144.7° |
| S07 | N10 | C11 | H111 | 9.0° | 24.7° |
| C04 | S07 | O09 | O08 | 121.7° | 122.9° |
| S07 | C04 | C03 | H031 | 0.4° | 0.0° |
| S07 | C04 | C05 | H051 | 1.5° | 0.1° |
| C41 | C14 | C12 | H121 | 67.1° | 55.9° |
| C41 | C14 | H142 | H141 | 117.6° | 120.0° |
| C14 | C41 | H411 | H412 | 120.0° | 120.0° |
| C14 | C41 | H411 | H413 | 120.0° | 120.0° |
| C14 | C41 | H412 | H413 | 120.0° | 120.0° |
| C31 | C18 | N19 | H181 | 119.7° | 120.0° |
| C18 | C31 | C32 | H311 | 119.9° | 119.9° |
| C18 | C31 | C32 | H312 | 119.9° | 120.0° |
| C31 | C18 | N19 | C20 | 131.9° | 84.9° |
| C18 | C31 | C32 | C37 | 111.0° | 90.0° |
| C18 | C31 | C32 | C33 | 69.9° | 89.8° |
| C31 | C18 | C16 | H161 | 170.5° | 175.0° |
| C18 | C31 | H311 | H312 | 120.4° | 119.9° |
| C31 | C18 | N19 | H191 | 48.1° | 95.0° |
| N19 | C18 | C31 | C32 | 59.2° | 64.9° |
| C18 | N19 | C20 | H191 | 180.0° | 180.0° |
| C18 | N19 | C20 | O22 | 173.1° | 180.0° |
| C18 | N19 | C20 | O21 | 7.0° | 0.0° |
| N19 | C18 | C16 | H161 | 55.5° | 55.0° |
| N19 | C18 | C31 | H311 | 60.6° | 55.0° |
| N19 | C18 | C31 | H312 | 179.1° | 175.0° |
| C31 | C32 | C37 | C33 | 179.1° | 179.8° |
| C31 | C32 | C37 | C36 | 179.9° | 179.7° |
| C31 | C32 | C33 | C34 | 179.4° | 179.9° |
| C32 | C31 | C18 | H181 | 61.3° | 55.0° |
| C32 | C31 | H311 | H312 | 120.3° | 120.1° |
| C31 | C32 | C33 | H331 | 0.6° | 0.0° |
| C31 | C32 | C37 | H371 | 0.1° | 0.0° |
| N19 | C20 | O22 | O21 | 179.9° | 180.0° |
| N19 | C20 | O22 | C23 | 170.9° | 180.0° |
| C20 | N19 | C18 | H181 | 12.3° | 35.0° |
| C20 | O22 | C23 | C24 | 142.8° | 91.5° |
| C20 | O22 | C23 | C26 | 103.3° | 153.7° |
| C20 | O22 | C23 | H231 | 15.9° | 31.2° |
| O22 | C20 | N19 | H191 | 6.9° | 0.0° |
| O21 | C20 | O22 | C23 | 9.0° | 0.0° |
| O21 | C20 | N19 | H191 | 173.0° | 180.0° |
| C32 | C37 | C36 | H371 | 180.0° | 179.8° |
| C37 | C32 | C33 | C34 | 1.5° | 0.3° |
| C32 | C37 | C36 | C35 | 0.3° | 0.4° |
| C37 | C32 | C31 | H311 | 8.9° | 29.9° |
| C37 | C32 | C31 | H312 | 129.1° | 150.0° |
| C37 | C32 | C33 | H331 | 178.5° | 179.8° |
| C32 | C37 | C36 | H361 | 179.7° | 179.7° |
| C33 | C32 | C37 | C36 | 1.0° | 0.5° |
| C32 | C33 | C34 | H331 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 1.2° | 0.1° |
| C33 | C32 | C31 | H311 | 170.2° | 150.3° |
| C33 | C32 | C31 | H312 | 50.0° | 30.2° |
| C32 | C33 | C34 | H341 | 178.8° | 180.0° |
| C33 | C32 | C37 | H371 | 179.0° | 179.8° |
| O22 | C23 | C24 | O25 | 83.7° | 143.1° |
| O22 | C23 | C24 | C26 | 115.8° | 118.7° |
| O22 | C23 | C24 | H231 | 124.3° | 122.7° |
| O22 | C23 | C26 | H231 | 120.3° | 122.6° |
| O22 | C23 | C26 | C27 | 86.9° | 119.4° |
| O22 | C23 | C26 | C28 | 29.8° | 8.4° |
| O22 | C23 | C24 | H242 | 35.6° | 98.0° |
| O22 | C23 | C24 | H241 | 156.9° | 24.3° |
| O22 | C23 | C26 | H261 | 149.1° | 117.7° |
| C37 | C36 | C35 | H361 | 180.0° | 179.8° |
| C37 | C36 | C35 | C34 | 0.1° | 0.2° |
| C37 | C36 | C35 | H351 | 179.9° | 179.8° |
| O25 | C24 | C23 | H242 | 119.3° | 118.9° |
| O25 | C24 | C23 | H241 | 119.3° | 118.8° |
| O25 | C24 | C23 | C26 | 32.1° | 24.4° |
| C24 | O25 | C27 | O30 | 123.8° | 71.7° |
| C24 | O25 | C27 | C26 | 7.8° | 40.0° |
| O25 | C24 | H242 | H241 | 121.9° | 122.3° |
| O25 | C24 | C23 | H231 | 151.9° | 94.2° |
| C24 | O25 | C27 | H271 | 117.6° | 162.7° |
| C23 | C24 | O25 | C27 | 27.3° | 40.6° |
| C24 | C23 | C26 | H231 | 123.9° | 118.7° |
| C24 | C23 | C26 | C27 | 29.0° | 0.7° |
| C24 | C23 | C26 | C28 | 145.7° | 110.3° |
| C23 | C24 | H242 | H241 | 122.0° | 122.3° |
| C24 | C23 | C26 | H261 | 95.0° | 123.6° |
| C33 | C34 | C35 | C36 | 0.5° | 0.1° |
| C33 | C34 | C35 | H341 | 180.0° | 179.9° |
| C33 | C34 | C35 | H351 | 179.4° | 180.0° |
| O25 | C27 | C26 | C23 | 9.8° | 23.2° |
| O25 | C27 | O30 | C29 | 117.0° | 150.8° |
| O25 | C27 | O30 | C26 | 116.2° | 111.7° |
| O25 | C27 | O30 | H271 | 119.1° | 125.6° |
| O25 | C27 | C26 | H271 | 122.7° | 122.5° |
| O25 | C27 | C26 | C28 | 128.6° | 137.3° |
| C27 | O25 | C24 | H242 | 146.6° | 159.5° |
| C27 | O25 | C24 | H241 | 92.0° | 78.2° |
| O25 | C27 | C26 | H261 | 110.4° | 99.5° |
| C23 | C26 | C27 | O30 | 106.0° | 91.6° |
| C23 | C26 | C28 | C29 | 93.1° | 112.1° |
| C23 | C26 | C27 | C28 | 118.8° | 114.1° |
| C23 | C26 | C27 | H261 | 120.2° | 122.7° |
| C23 | C26 | C28 | H261 | 119.2° | 126.1° |
| C26 | C23 | C24 | H242 | 151.4° | 143.3° |
| C26 | C23 | C24 | H241 | 87.3° | 94.4° |
| C23 | C26 | C28 | H281 | 147.3° | 6.6° |
| C23 | C26 | C28 | H282 | 26.5° | 129.1° |
| C23 | C26 | C27 | H271 | 132.5° | 145.7° |
| O30 | C29 | C28 | H291 | 119.5° | 118.8° |
| O30 | C29 | C28 | H292 | 119.5° | 119.0° |
| C29 | O30 | C27 | C26 | 0.8° | 39.1° |
| O30 | C29 | C28 | C26 | 21.2° | 24.6° |
| O30 | C29 | C28 | H281 | 98.4° | 94.1° |
| O30 | C29 | C28 | H282 | 140.8° | 143.3° |
| C29 | O30 | C27 | H271 | 123.9° | 83.6° |
| O30 | C29 | H291 | H292 | 121.4° | 122.6° |
| C27 | O30 | C29 | C28 | 14.3° | 40.3° |
| O30 | C27 | C26 | H271 | 121.5° | 122.7° |
| O30 | C27 | C26 | C28 | 12.8° | 22.4° |
| O30 | C27 | C26 | H261 | 133.8° | 145.6° |
| C27 | O30 | C29 | H291 | 133.8° | 159.0° |
| C27 | O30 | C29 | H292 | 105.2° | 78.6° |
| C29 | C28 | C26 | C27 | 23.0° | 1.6° |
| C29 | C28 | C26 | H281 | 119.6° | 118.7° |
| C29 | C28 | C26 | H282 | 119.6° | 118.8° |
| C29 | C28 | C26 | H261 | 147.7° | 121.7° |
| C29 | C28 | H281 | H282 | 121.2° | 122.7° |
| C28 | C29 | H291 | H292 | 121.5° | 122.3° |
| C36 | C35 | C34 | H351 | 180.0° | 179.9° |
| C36 | C35 | C34 | H341 | 179.5° | 180.0° |
| C35 | C36 | C37 | H371 | 179.7° | 179.8° |
| C27 | C26 | C28 | H261 | 124.6° | 123.3° |
| C27 | C26 | C28 | H281 | 96.6° | 117.2° |
| C27 | C26 | C28 | H282 | 142.6° | 120.3° |
| C27 | C26 | C23 | H231 | 152.9° | 118.0° |
| C35 | C34 | C33 | H331 | 178.7° | 180.0° |
| C34 | C35 | C36 | H361 | 179.9° | 179.9° |
| C26 | C28 | H281 | H282 | 121.2° | 122.5° |
| C28 | C26 | C23 | H231 | 90.4° | 131.0° |
| C28 | C26 | C27 | H271 | 108.7° | 100.2° |
| C26 | C28 | C29 | H291 | 140.7° | 143.4° |
| C26 | C28 | C29 | H292 | 98.3° | 94.4° |
| H131 | C13 | C12 | H121 | 61.8° | 67.3° |
| H131 | C13 | C42 | H421 | 59.7° | 61.0° |
| H131 | C13 | C42 | H423 | 60.3° | 59.0° |
| H131 | C13 | C42 | H422 | 179.7° | 179.0° |
| H132 | C13 | C12 | H121 | 57.5° | 172.7° |
| H132 | C13 | C42 | H421 | 59.7° | 179.0° |
| H132 | C13 | C42 | H423 | 179.7° | 61.0° |
| H132 | C13 | C42 | H422 | 60.4° | 59.0° |
| H151 | C15 | C16 | H161 | 163.5° | 66.4° |
| H152 | C15 | C16 | H161 | 76.2° | 173.6° |
| H242 | C24 | C23 | H231 | 88.7° | 24.7° |
| H241 | C24 | C23 | H231 | 32.6° | 147.0° |
| H261 | C26 | C28 | H281 | 28.1° | 119.5° |
| H261 | C26 | C28 | H282 | 92.7° | 3.0° |
| H261 | C26 | C23 | H231 | 28.9° | 4.9° |
| H261 | C26 | C27 | H271 | 12.3° | 23.0° |
| H281 | C28 | C29 | H291 | 21.1° | 24.7° |
| H281 | C28 | C29 | H292 | 142.1° | 146.9° |
| H282 | C28 | C29 | H291 | 99.7° | 97.9° |
| H282 | C28 | C29 | H292 | 21.3° | 24.3° |
| H021 | C02 | C03 | H031 | 1.4° | 0.1° |
| H051 | C05 | C06 | H061 | 0.9° | 0.1° |
| H112 | C11 | C12 | H121 | 59.1° | 54.0° |
| H111 | C11 | C12 | H121 | 178.2° | 66.0° |
| H121 | C12 | C14 | H142 | 53.6° | 175.9° |
| H121 | C12 | C14 | H141 | 172.1° | 64.1° |
| H142 | C14 | C41 | H411 | 59.3° | 63.7° |
| H142 | C14 | C41 | H412 | 179.3° | 176.3° |
| H142 | C14 | C41 | H413 | 60.7° | 56.3° |
| H141 | C14 | C41 | H411 | 59.2° | 56.2° |
| H141 | C14 | C41 | H412 | 60.8° | 63.7° |
| H141 | C14 | C41 | H413 | 179.2° | 176.2° |
| H161 | C16 | C18 | H181 | 67.0° | 65.0° |
| H161 | C16 | O17 | H171 | 60.5° | 174.8° |
| H181 | C18 | C31 | H311 | 178.8° | 175.0° |
| H181 | C18 | C31 | H312 | 58.5° | 65.1° |
| H181 | C18 | N19 | H191 | 167.7° | 145.0° |
| H331 | C33 | C34 | H341 | 1.3° | 0.0° |
| H341 | C34 | C35 | H351 | 0.5° | 0.1° |
| H351 | C35 | C36 | H361 | 0.1° | 0.0° |
| H361 | C36 | C37 | H371 | 0.3° | 0.0° |
| H381 | C38 | C39 | H391 | 55.3° | 59.9° |
| H381 | C38 | C39 | H392 | 64.7° | 60.0° |
| H381 | C38 | C39 | H393 | 175.3° | 180.0° |
| H381 | C38 | O40 | H401 | 56.4° | 180.0° |
| H391 | C39 | H392 | H393 | 119.9° | 119.9° |
| H411 | C41 | H412 | H413 | 120.0° | 120.0° |
| H421 | C42 | H423 | H422 | 120.0° | 120.0° |
