W3F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.38Å | 1.53Å | Aromatic |
| C01 | C06 | sing | 1.38Å | 1.32Å | Aromatic |
| C02 | C03 | sing | 1.39Å | 1.32Å | Aromatic |
| C02 | F35 | sing | 1.35Å | 1.36Å | |
| C03 | C04 | doub | 1.38Å | 1.53Å | Aromatic |
| C04 | C05 | sing | 1.38Å | 1.32Å | Aromatic |
| C05 | C06 | doub | 1.38Å | 1.53Å | Aromatic |
| C05 | C07 | sing | 1.51Å | 1.53Å | |
| C07 | C12 | sing | 1.53Å | 1.53Å | |
| C07 | N08 | sing | 1.47Å | 1.45Å | |
| C09 | C10 | sing | 1.48Å | 1.53Å | |
| C09 | N08 | sing | 1.35Å | 1.45Å | |
| C09 | O11 | doub | 1.22Å | 1.18Å | |
| C10 | C13 | doub | 1.40Å | 1.45Å | Aromatic |
| C10 | C17 | sing | 1.39Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.35Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.52Å | Aromatic |
| C15 | N18 | sing | 1.38Å | 1.42Å | |
| C16 | C17 | doub | 1.39Å | 1.36Å | Aromatic |
| C16 | C20 | sing | 1.48Å | 1.36Å | |
| C19 | C20 | sing | 1.47Å | 1.34Å | |
| C19 | N18 | sing | 1.34Å | 1.32Å | |
| C19 | O21 | doub | 1.22Å | 1.40Å | |
| C20 | C22 | doub | 1.38Å | 1.41Å | |
| C22 | C23 | sing | 1.41Å | 1.53Å | |
| C23 | C27 | doub | 1.39Å | 1.38Å | Aromatic |
| C23 | N24 | sing | 1.38Å | 1.35Å | Aromatic |
| C25 | C26 | doub | 1.36Å | 1.37Å | Aromatic |
| C25 | C29 | sing | 1.51Å | 1.53Å | |
| C25 | N24 | sing | 1.36Å | 1.35Å | Aromatic |
| C26 | C27 | sing | 1.40Å | 1.35Å | Aromatic |
| C26 | N30 | sing | 1.41Å | 1.45Å | |
| C27 | C28 | sing | 1.51Å | 1.53Å | |
| C31 | C32 | sing | 1.51Å | 1.52Å | |
| C31 | N30 | sing | 1.35Å | 1.45Å | |
| C31 | O33 | doub | 1.21Å | 1.19Å | |
| C32 | C34 | sing | 1.51Å | 1.53Å | |
| C32 | O40 | sing | 1.43Å | 1.43Å | |
| C34 | C36 | doub | 1.34Å | 1.41Å | Aromatic |
| C34 | O39 | sing | 1.34Å | 1.37Å | Aromatic |
| C36 | C37 | sing | 1.41Å | 1.43Å | Aromatic |
| C37 | C38 | doub | 1.34Å | 1.39Å | Aromatic |
| C38 | O39 | sing | 1.34Å | 1.36Å | Aromatic |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| C32 | H1 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| N08 | H081 | sing | 0.97Å | 1.00Å | |
| N18 | H181 | sing | 0.97Å | 1.00Å | |
| N24 | H241 | sing | 0.97Å | 1.00Å | |
| N30 | H301 | sing | 0.97Å | 1.00Å | |
| O40 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C06 | 120.0° | 120.0° |
| C01 | C02 | C03 | 120.0° | 120.0° |
| C01 | C02 | F35 | 119.8° | 120.1° |
| C02 | C01 | H011 | 120.0° | 120.0° |
| C01 | C06 | C05 | 120.0° | 120.0° |
| C06 | C01 | H011 | 120.0° | 120.0° |
| C01 | C06 | H061 | 120.0° | 120.0° |
| C03 | C02 | F35 | 120.2° | 120.0° |
| C02 | C03 | C04 | 120.0° | 119.9° |
| C02 | C03 | H031 | 120.0° | 120.0° |
| C03 | C04 | C05 | 120.0° | 120.0° |
| C04 | C03 | H031 | 120.0° | 120.0° |
| C03 | C04 | H041 | 120.0° | 119.9° |
| C04 | C05 | C06 | 120.0° | 120.1° |
| C04 | C05 | C07 | 120.3° | 119.9° |
| C05 | C04 | H041 | 120.0° | 120.1° |
| C06 | C05 | C07 | 119.8° | 120.0° |
| C05 | C06 | H061 | 120.0° | 119.9° |
| C05 | C07 | C12 | 109.9° | 109.5° |
| C05 | C07 | N08 | 109.7° | 109.5° |
| C05 | C07 | H071 | 109.1° | 109.5° |
| C12 | C07 | N08 | 108.8° | 109.4° |
| C12 | C07 | H071 | 109.1° | 109.5° |
| C07 | C12 | H123 | 109.5° | 109.5° |
| C07 | C12 | H122 | 109.4° | 109.4° |
| C07 | C12 | H121 | 109.4° | 109.5° |
| C07 | N08 | C09 | 120.5° | 120.0° |
| N08 | C07 | H071 | 110.2° | 109.5° |
| C07 | N08 | H081 | 119.8° | 120.0° |
| C10 | C09 | N08 | 119.5° | 120.0° |
| C10 | C09 | O11 | 120.3° | 120.0° |
| C09 | C10 | C13 | 120.6° | 120.1° |
| C09 | C10 | C17 | 119.7° | 120.1° |
| N08 | C09 | O11 | 120.3° | 120.0° |
| C09 | N08 | H081 | 119.7° | 120.0° |
| C13 | C10 | C17 | 119.7° | 119.8° |
| C10 | C13 | C14 | 120.5° | 120.4° |
| C10 | C13 | H131 | 119.8° | 119.7° |
| C10 | C17 | C16 | 120.1° | 119.6° |
| C10 | C17 | H171 | 119.9° | 120.3° |
| C13 | C14 | C15 | 120.3° | 120.4° |
| C14 | C13 | H131 | 119.7° | 119.8° |
| C13 | C14 | H141 | 119.9° | 119.8° |
| C14 | C15 | C16 | 119.4° | 119.3° |
| C14 | C15 | N18 | 137.2° | 131.6° |
| C15 | C14 | H141 | 119.9° | 119.8° |
| C16 | C15 | N18 | 103.4° | 109.1° |
| C15 | C16 | C17 | 120.0° | 120.5° |
| C15 | C16 | C20 | 100.3° | 106.3° |
| C15 | N18 | C19 | 113.8° | 111.5° |
| C15 | N18 | H181 | 123.1° | 124.3° |
| C17 | C16 | C20 | 139.7° | 133.2° |
| C16 | C17 | H171 | 119.9° | 120.2° |
| C16 | C20 | C19 | 118.6° | 105.0° |
| C16 | C20 | C22 | 115.8° | 127.5° |
| C20 | C19 | N18 | 103.8° | 108.1° |
| C20 | C19 | O21 | 131.2° | 126.0° |
| C19 | C20 | C22 | 125.6° | 127.5° |
| N18 | C19 | O21 | 125.0° | 126.0° |
| C19 | N18 | H181 | 123.1° | 124.2° |
| C20 | C22 | C23 | 126.0° | 120.0° |
| C20 | C22 | H221 | 117.0° | 120.1° |
| C22 | C23 | C27 | 124.7° | 126.2° |
| C22 | C23 | N24 | 127.8° | 126.2° |
| C23 | C22 | H221 | 117.0° | 120.0° |
| C27 | C23 | N24 | 107.5° | 107.6° |
| C23 | C27 | C26 | 107.7° | 107.1° |
| C23 | C27 | C28 | 125.9° | 126.5° |
| C23 | N24 | C25 | 108.5° | 108.7° |
| C23 | N24 | H241 | 125.8° | 125.7° |
| C26 | C25 | C29 | 125.0° | 125.6° |
| C26 | C25 | N24 | 108.0° | 108.9° |
| C25 | C26 | C27 | 108.2° | 107.8° |
| C25 | C26 | N30 | 121.9° | 126.1° |
| C29 | C25 | N24 | 126.9° | 125.6° |
| C25 | C29 | H291 | 109.5° | 109.5° |
| C25 | C29 | H292 | 109.5° | 109.5° |
| C25 | C29 | H293 | 109.5° | 109.5° |
| C25 | N24 | H241 | 125.8° | 125.6° |
| C27 | C26 | N30 | 129.9° | 126.1° |
| C26 | C27 | C28 | 126.3° | 126.5° |
| C26 | N30 | C31 | 120.4° | 120.0° |
| C26 | N30 | H301 | 119.8° | 120.0° |
| C27 | C28 | H283 | 109.5° | 109.5° |
| C27 | C28 | H281 | 109.4° | 109.5° |
| C27 | C28 | H282 | 109.5° | 109.5° |
| C32 | C31 | N30 | 118.4° | 120.0° |
| C32 | C31 | O33 | 120.6° | 120.0° |
| C31 | C32 | C34 | 101.8° | 109.4° |
| C31 | C32 | O40 | 111.6° | 109.5° |
| C31 | C32 | H1 | 110.2° | 109.5° |
| N30 | C31 | O33 | 120.9° | 120.0° |
| C31 | N30 | H301 | 119.8° | 120.0° |
| C34 | C32 | O40 | 111.2° | 109.5° |
| C32 | C34 | C36 | 126.6° | 125.8° |
| C32 | C34 | O39 | 126.7° | 125.8° |
| C34 | C32 | H1 | 110.1° | 109.4° |
| O40 | C32 | H1 | 111.5° | 109.5° |
| C32 | O40 | H2 | 109.5° | 114.0° |
| C36 | C34 | O39 | 106.8° | 108.4° |
| C34 | C36 | C37 | 107.2° | 106.8° |
| C34 | C36 | H361 | 126.4° | 126.6° |
| C34 | O39 | C38 | 110.9° | 109.5° |
| C36 | C37 | C38 | 107.2° | 106.8° |
| C37 | C36 | H361 | 126.4° | 126.6° |
| C36 | C37 | H371 | 126.4° | 126.6° |
| C37 | C38 | O39 | 108.0° | 108.4° |
| C38 | C37 | H371 | 126.4° | 126.6° |
| C37 | C38 | H381 | 126.0° | 125.8° |
| O39 | C38 | H381 | 126.0° | 125.8° |
| H123 | C12 | H122 | 109.5° | 109.4° |
| H123 | C12 | H121 | 109.5° | 109.5° |
| H122 | C12 | H121 | 109.5° | 109.5° |
| H283 | C28 | H281 | 109.5° | 109.5° |
| H283 | C28 | H282 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.4° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.4° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C06 | H011 | 180.0° | 179.7° |
| C01 | C02 | C03 | F35 | 180.0° | 179.9° |
| C01 | C02 | C03 | C04 | 0.1° | 0.1° |
| C02 | C01 | C06 | C05 | 0.1° | 0.0° |
| C01 | C02 | C03 | H031 | 179.9° | 180.0° |
| C02 | C01 | C06 | H061 | 179.9° | 180.0° |
| C06 | C01 | C02 | C03 | 0.1° | 0.0° |
| C06 | C01 | C02 | F35 | 179.9° | 179.9° |
| C01 | C06 | C05 | C04 | 0.0° | 0.1° |
| C01 | C06 | C05 | H061 | 180.0° | 179.9° |
| C01 | C06 | C05 | C07 | 179.9° | 180.0° |
| C02 | C03 | C04 | H031 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 0.0° | 0.0° |
| C03 | C02 | C01 | H011 | 180.0° | 179.8° |
| C02 | C03 | C04 | H041 | 180.0° | 180.0° |
| F35 | C02 | C03 | C04 | 180.0° | 180.0° |
| F35 | C02 | C01 | H011 | 0.0° | 0.3° |
| F35 | C02 | C03 | H031 | 0.1° | 0.1° |
| C03 | C04 | C05 | H041 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.0° | 0.0° |
| C03 | C04 | C05 | C07 | 179.9° | 180.0° |
| C04 | C05 | C06 | C07 | 179.9° | 180.0° |
| C04 | C05 | C07 | C12 | 71.7° | 100.0° |
| C04 | C05 | C07 | N08 | 47.9° | 140.0° |
| C05 | C04 | C03 | H031 | 179.9° | 180.0° |
| C04 | C05 | C06 | H061 | 179.9° | 180.0° |
| C04 | C05 | C07 | H071 | 168.7° | 20.0° |
| C06 | C05 | C07 | C12 | 108.4° | 80.0° |
| C06 | C05 | C07 | N08 | 132.0° | 39.9° |
| C05 | C06 | C01 | H011 | 180.0° | 179.7° |
| C06 | C05 | C04 | H041 | 180.0° | 180.0° |
| C06 | C05 | C07 | H071 | 11.2° | 159.9° |
| C05 | C07 | C12 | N08 | 120.2° | 120.0° |
| C05 | C07 | C12 | H071 | 119.6° | 120.0° |
| C05 | C07 | N08 | H071 | 120.2° | 120.0° |
| C05 | C07 | N08 | C09 | 113.3° | 155.0° |
| C07 | C05 | C04 | H041 | 0.1° | 0.0° |
| C07 | C05 | C06 | H061 | 0.0° | 0.1° |
| C05 | C07 | C12 | H123 | 180.0° | 180.0° |
| C05 | C07 | C12 | H122 | 60.0° | 60.1° |
| C05 | C07 | C12 | H121 | 60.0° | 60.0° |
| C05 | C07 | N08 | H081 | 66.7° | 25.0° |
| C12 | C07 | N08 | H071 | 119.6° | 120.0° |
| C12 | C07 | N08 | C09 | 126.5° | 85.0° |
| C07 | C12 | H123 | H122 | 120.0° | 119.9° |
| C07 | C12 | H123 | H121 | 120.0° | 120.0° |
| C07 | C12 | H122 | H121 | 119.9° | 120.0° |
| C12 | C07 | N08 | H081 | 53.5° | 95.0° |
| C07 | N08 | C09 | C10 | 180.0° | 180.0° |
| C07 | N08 | C09 | H081 | 180.0° | 180.0° |
| C07 | N08 | C09 | O11 | 0.7° | 0.0° |
| N08 | C07 | C12 | H123 | 59.8° | 60.1° |
| N08 | C07 | C12 | H122 | 179.9° | 180.0° |
| N08 | C07 | C12 | H121 | 60.2° | 60.0° |
| C10 | C09 | N08 | O11 | 179.3° | 180.0° |
| C09 | C10 | C13 | C17 | 179.8° | 179.7° |
| C09 | C10 | C13 | C14 | 179.9° | 180.0° |
| C09 | C10 | C17 | C16 | 179.9° | 179.8° |
| C09 | C10 | C13 | H131 | 0.1° | 0.0° |
| C09 | C10 | C17 | H171 | 0.1° | 0.0° |
| C10 | C09 | N08 | H081 | 0.0° | 0.0° |
| N08 | C09 | C10 | C13 | 163.1° | 0.0° |
| N08 | C09 | C10 | C17 | 17.1° | 179.7° |
| C09 | N08 | C07 | H071 | 6.9° | 35.0° |
| O11 | C09 | C10 | C13 | 16.2° | 180.0° |
| O11 | C09 | C10 | C17 | 163.6° | 0.3° |
| O11 | C09 | N08 | H081 | 179.3° | 180.0° |
| C10 | C13 | C14 | H131 | 180.0° | 180.0° |
| C10 | C13 | C14 | C15 | 0.2° | 0.1° |
| C13 | C10 | C17 | C16 | 0.2° | 0.5° |
| C10 | C13 | C14 | H141 | 179.8° | 180.0° |
| C13 | C10 | C17 | H171 | 179.7° | 179.7° |
| C17 | C10 | C13 | C14 | 0.3° | 0.3° |
| C10 | C17 | C16 | C15 | 0.1° | 0.5° |
| C10 | C17 | C16 | H171 | 180.0° | 179.8° |
| C10 | C17 | C16 | C20 | 179.9° | 179.9° |
| C17 | C10 | C13 | H131 | 179.8° | 179.7° |
| C13 | C14 | C15 | H141 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.1° | 0.1° |
| C13 | C14 | C15 | N18 | 179.9° | 180.0° |
| C14 | C15 | C16 | N18 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.0° | 0.3° |
| C14 | C15 | C16 | C20 | 180.0° | 180.0° |
| C14 | C15 | N18 | C19 | 180.0° | 180.0° |
| C15 | C14 | C13 | H131 | 179.9° | 180.0° |
| C14 | C15 | N18 | H181 | 0.1° | 0.0° |
| C15 | C16 | C17 | C20 | 180.0° | 179.7° |
| C15 | C16 | C20 | C19 | 0.0° | 0.0° |
| C16 | C15 | N18 | C19 | 0.0° | 0.1° |
| C15 | C16 | C20 | C22 | 179.8° | 180.0° |
| C16 | C15 | C14 | H141 | 180.0° | 180.0° |
| C15 | C16 | C17 | H171 | 179.9° | 179.7° |
| C16 | C15 | N18 | H181 | 179.9° | 180.0° |
| N18 | C15 | C16 | C17 | 180.0° | 179.8° |
| N18 | C15 | C16 | C20 | 0.0° | 0.0° |
| C15 | N18 | C19 | C20 | 0.1° | 0.0° |
| C15 | N18 | C19 | H181 | 180.0° | 180.0° |
| C15 | N18 | C19 | O21 | 179.9° | 180.0° |
| N18 | C15 | C14 | H141 | 0.0° | 0.0° |
| C17 | C16 | C20 | C19 | 180.0° | 179.7° |
| C17 | C16 | C20 | C22 | 0.3° | 0.3° |
| C16 | C20 | C19 | C22 | 179.7° | 180.0° |
| C16 | C20 | C19 | N18 | 0.0° | 0.0° |
| C16 | C20 | C19 | O21 | 179.9° | 180.0° |
| C16 | C20 | C22 | C23 | 173.0° | 172.8° |
| C20 | C16 | C17 | H171 | 0.1° | 0.0° |
| C16 | C20 | C22 | H221 | 7.0° | 7.2° |
| C20 | C19 | N18 | O21 | 179.9° | 180.0° |
| C19 | C20 | C22 | C23 | 6.7° | 7.3° |
| C19 | C20 | C22 | H221 | 173.3° | 172.7° |
| C20 | C19 | N18 | H181 | 179.9° | 180.0° |
| N18 | C19 | C20 | C22 | 179.8° | 180.0° |
| O21 | C19 | C20 | C22 | 0.3° | 0.0° |
| O21 | C19 | N18 | H181 | 0.0° | 0.0° |
| C20 | C22 | C23 | H221 | 180.0° | 180.0° |
| C20 | C22 | C23 | C27 | 174.7° | 147.9° |
| C20 | C22 | C23 | N24 | 4.8° | 32.4° |
| C22 | C23 | C27 | N24 | 179.5° | 179.7° |
| C22 | C23 | N24 | C25 | 179.2° | 180.0° |
| C22 | C23 | C27 | C26 | 179.3° | 180.0° |
| C22 | C23 | C27 | C28 | 0.8° | 0.0° |
| C22 | C23 | N24 | H241 | 0.9° | 0.0° |
| C23 | C27 | C26 | C25 | 0.0° | 0.2° |
| C27 | C23 | N24 | C25 | 0.3° | 0.2° |
| C23 | C27 | C26 | C28 | 179.9° | 179.9° |
| C23 | C27 | C26 | N30 | 179.7° | 179.9° |
| C27 | C23 | C22 | H221 | 5.3° | 32.1° |
| C23 | C27 | C28 | H283 | 90.0° | 82.6° |
| C23 | C27 | C28 | H281 | 150.0° | 157.4° |
| C23 | C27 | C28 | H282 | 30.0° | 37.4° |
| C27 | C23 | N24 | H241 | 179.6° | 179.7° |
| C23 | N24 | C25 | C26 | 0.3° | 0.1° |
| C23 | N24 | C25 | C29 | 180.0° | 179.9° |
| C23 | N24 | C25 | H241 | 180.0° | 180.0° |
| N24 | C23 | C27 | C26 | 0.2° | 0.3° |
| N24 | C23 | C27 | C28 | 179.7° | 179.8° |
| N24 | C23 | C22 | H221 | 175.2° | 147.6° |
| C26 | C25 | C29 | N24 | 179.7° | 180.0° |
| C25 | C26 | C27 | N30 | 179.7° | 179.9° |
| C25 | C26 | C27 | C28 | 179.9° | 179.9° |
| C25 | C26 | N30 | C31 | 92.8° | 145.5° |
| C26 | C25 | C29 | H291 | 89.8° | 95.0° |
| C26 | C25 | C29 | H292 | 150.2° | 145.0° |
| C26 | C25 | C29 | H293 | 30.2° | 25.1° |
| C26 | C25 | N24 | H241 | 179.7° | 179.8° |
| C25 | C26 | N30 | H301 | 87.2° | 34.5° |
| C29 | C25 | C26 | C27 | 179.9° | 180.0° |
| C29 | C25 | C26 | N30 | 0.2° | 0.1° |
| C25 | C29 | H291 | H292 | 120.0° | 120.0° |
| C25 | C29 | H291 | H293 | 120.0° | 120.0° |
| C25 | C29 | H292 | H293 | 120.0° | 120.0° |
| C29 | C25 | N24 | H241 | 0.1° | 0.2° |
| N24 | C25 | C26 | C27 | 0.2° | 0.1° |
| N24 | C25 | C26 | N30 | 179.5° | 180.0° |
| N24 | C25 | C29 | H291 | 89.8° | 85.0° |
| N24 | C25 | C29 | H292 | 30.2° | 35.0° |
| N24 | C25 | C29 | H293 | 150.2° | 154.9° |
| C27 | C26 | N30 | C31 | 87.6° | 34.3° |
| C26 | C27 | C28 | H283 | 90.0° | 97.5° |
| C26 | C27 | C28 | H281 | 30.1° | 22.5° |
| C26 | C27 | C28 | H282 | 150.0° | 142.5° |
| C27 | C26 | N30 | H301 | 92.4° | 145.6° |
| N30 | C26 | C27 | C28 | 0.2° | 0.0° |
| C26 | N30 | C31 | C32 | 177.6° | 174.9° |
| C26 | N30 | C31 | H301 | 180.0° | 179.9° |
| C26 | N30 | C31 | O33 | 0.6° | 5.1° |
| C27 | C28 | H283 | H281 | 120.0° | 120.0° |
| C27 | C28 | H283 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H282 | 120.0° | 120.0° |
| C32 | C31 | N30 | O33 | 178.2° | 180.0° |
| C31 | C32 | C34 | O40 | 119.0° | 120.0° |
| C31 | C32 | C34 | H1 | 116.9° | 120.0° |
| C31 | C32 | O40 | H1 | 123.8° | 120.1° |
| C31 | C32 | C34 | C36 | 84.7° | 100.0° |
| C31 | C32 | C34 | O39 | 93.6° | 80.3° |
| C32 | C31 | N30 | H301 | 2.4° | 5.0° |
| C31 | C32 | O40 | H2 | 180.0° | 59.9° |
| N30 | C31 | C32 | C34 | 90.1° | 65.0° |
| N30 | C31 | C32 | O40 | 28.6° | 175.0° |
| N30 | C31 | C32 | H1 | 153.1° | 55.0° |
| O33 | C31 | C32 | C34 | 88.1° | 115.0° |
| O33 | C31 | C32 | O40 | 153.3° | 4.9° |
| O33 | C31 | C32 | H1 | 28.7° | 125.0° |
| O33 | C31 | N30 | H301 | 179.4° | 175.0° |
| C34 | C32 | O40 | H1 | 123.3° | 120.0° |
| C32 | C34 | C36 | O39 | 178.5° | 179.8° |
| C32 | C34 | C36 | C37 | 179.2° | 180.0° |
| C32 | C34 | O39 | C38 | 179.2° | 179.8° |
| C32 | C34 | C36 | H361 | 0.7° | 0.0° |
| C34 | C32 | O40 | H2 | 67.0° | 60.0° |
| O40 | C32 | C34 | C36 | 34.4° | 140.0° |
| O40 | C32 | C34 | O39 | 147.4° | 39.7° |
| C34 | C36 | C37 | H361 | 180.0° | 180.0° |
| C34 | C36 | C37 | C38 | 0.5° | 0.0° |
| C36 | C34 | O39 | C38 | 0.6° | 0.4° |
| C36 | C34 | C32 | H1 | 158.4° | 20.0° |
| C34 | C36 | C37 | H371 | 179.5° | 180.0° |
| O39 | C34 | C36 | C37 | 0.7° | 0.3° |
| C34 | O39 | C38 | C37 | 0.3° | 0.4° |
| O39 | C34 | C32 | H1 | 23.3° | 159.7° |
| O39 | C34 | C36 | H361 | 179.3° | 179.7° |
| C34 | O39 | C38 | H381 | 179.7° | 179.8° |
| C36 | C37 | C38 | H371 | 180.0° | 180.0° |
| C36 | C37 | C38 | O39 | 0.2° | 0.3° |
| C36 | C37 | C38 | H381 | 179.8° | 179.9° |
| C37 | C38 | O39 | H381 | 180.0° | 179.8° |
| C38 | C37 | C36 | H361 | 179.4° | 180.0° |
| O39 | C38 | C37 | H371 | 179.9° | 179.7° |
| H011 | C01 | C06 | H061 | 0.1° | 0.2° |
| H031 | C03 | C04 | H041 | 0.1° | 0.0° |
| H071 | C07 | C12 | H123 | 60.4° | 59.9° |
| H071 | C07 | C12 | H122 | 59.7° | 60.0° |
| H071 | C07 | C12 | H121 | 179.6° | 180.0° |
| H071 | C07 | N08 | H081 | 173.1° | 145.0° |
| H123 | C12 | H122 | H121 | 120.0° | 120.1° |
| H131 | C13 | C14 | H141 | 0.1° | 0.0° |
| H283 | C28 | H281 | H282 | 120.0° | 120.0° |
| H291 | C29 | H292 | H293 | 120.0° | 120.0° |
| H1 | C32 | O40 | H2 | 56.2° | 180.0° |
| H361 | C36 | C37 | H371 | 0.5° | 0.0° |
| H371 | C37 | C38 | H381 | 0.1° | 0.1° |
