YJS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C39 | N40 | doub | 1.32Å | 1.35Å | Aromatic |
| C39 | C37 | sing | 1.38Å | 1.40Å | Aromatic |
| CL38 | C37 | sing | 1.74Å | 1.78Å | |
| N40 | C08 | sing | 1.33Å | 1.34Å | Aromatic |
| CL35 | C34 | sing | 1.74Å | 1.76Å | |
| C37 | C10 | doub | 1.40Å | 1.37Å | Aromatic |
| C05 | C06 | sing | 1.53Å | 1.49Å | |
| C05 | O04 | sing | 1.43Å | 1.42Å | |
| C06 | N07 | sing | 1.47Å | 1.40Å | |
| C08 | N07 | sing | 1.39Å | 1.46Å | |
| C08 | C09 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C09 | sing | 1.39Å | 1.42Å | Aromatic |
| C10 | N11 | sing | 1.40Å | 1.44Å | |
| N07 | C02 | sing | 1.47Å | 1.42Å | |
| C34 | C36 | doub | 1.38Å | 1.34Å | Aromatic |
| C34 | C32 | sing | 1.39Å | 1.37Å | Aromatic |
| O33 | C32 | sing | 1.36Å | 1.39Å | |
| N11 | C12 | sing | 1.35Å | 1.38Å | |
| C36 | C26 | sing | 1.40Å | 1.39Å | Aromatic |
| O04 | C03 | sing | 1.43Å | 1.43Å | |
| C32 | C28 | doub | 1.40Å | 1.37Å | Aromatic |
| C02 | C03 | sing | 1.53Å | 1.50Å | |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| C12 | O13 | doub | 1.21Å | 1.22Å | |
| C12 | C14 | sing | 1.51Å | 1.54Å | |
| C16 | N15 | sing | 1.37Å | 1.33Å | Aromatic |
| C16 | C17 | doub | 1.36Å | 1.36Å | Aromatic |
| C26 | C17 | sing | 1.48Å | 1.51Å | |
| C26 | C27 | doub | 1.39Å | 1.36Å | Aromatic |
| C14 | N15 | sing | 1.47Å | 1.42Å | |
| C28 | C27 | sing | 1.40Å | 1.38Å | Aromatic |
| C28 | C29 | sing | 1.48Å | 1.51Å | |
| N30 | C29 | sing | 1.35Å | 1.47Å | |
| N15 | C19 | sing | 1.36Å | 1.37Å | Aromatic |
| C17 | C18 | sing | 1.47Å | 1.45Å | Aromatic |
| C29 | O31 | doub | 1.22Å | 1.20Å | |
| C19 | C18 | doub | 1.40Å | 1.35Å | Aromatic |
| C19 | N20 | sing | 1.34Å | 1.45Å | |
| C18 | C24 | sing | 1.41Å | 1.51Å | |
| N20 | C21 | doub | 1.30Å | 1.41Å | |
| C24 | O25 | doub | 1.22Å | 1.16Å | |
| C24 | N22 | sing | 1.35Å | 1.38Å | |
| C21 | N22 | sing | 1.36Å | 1.41Å | |
| N22 | C23 | sing | 1.46Å | 1.45Å | |
| N11 | H111 | sing | 0.97Å | 1.00Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| N30 | H301 | sing | 0.97Å | 1.00Å | |
| N30 | H302 | sing | 0.97Å | 1.00Å | |
| O33 | H331 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N40 | C39 | C37 | 118.6° | 120.9° |
| C39 | N40 | C08 | 121.3° | 121.8° |
| N40 | C39 | H391 | 120.7° | 119.6° |
| C39 | C37 | CL38 | 118.6° | 120.4° |
| C39 | C37 | C10 | 121.4° | 119.2° |
| C37 | C39 | H391 | 120.7° | 119.5° |
| CL38 | C37 | C10 | 119.9° | 120.4° |
| N40 | C08 | N07 | 116.7° | 119.6° |
| N40 | C08 | C09 | 122.5° | 120.7° |
| CL35 | C34 | C36 | 118.9° | 119.9° |
| CL35 | C34 | C32 | 120.5° | 119.9° |
| C37 | C10 | C09 | 118.5° | 118.4° |
| C37 | C10 | N11 | 118.6° | 120.8° |
| C06 | C05 | O04 | 109.3° | 109.2° |
| C05 | C06 | N07 | 110.2° | 109.2° |
| C06 | C05 | H051 | 109.5° | 109.5° |
| C06 | C05 | H052 | 109.5° | 109.5° |
| C05 | C06 | H061 | 109.3° | 109.5° |
| C05 | C06 | H062 | 109.3° | 109.5° |
| C05 | O04 | C03 | 115.1° | 113.8° |
| O04 | C05 | H051 | 109.5° | 109.5° |
| O04 | C05 | H052 | 109.5° | 109.5° |
| C06 | N07 | C08 | 117.5° | 111.0° |
| C06 | N07 | C02 | 113.6° | 110.8° |
| N07 | C06 | H061 | 109.3° | 109.5° |
| N07 | C06 | H062 | 109.3° | 109.5° |
| N07 | C08 | C09 | 120.8° | 119.7° |
| C08 | N07 | C02 | 119.0° | 111.0° |
| C08 | C09 | C10 | 117.5° | 119.0° |
| C08 | C09 | H091 | 121.3° | 120.5° |
| C09 | C10 | N11 | 122.7° | 120.8° |
| C10 | C09 | H091 | 121.2° | 120.5° |
| C10 | N11 | C12 | 125.4° | 120.0° |
| C10 | N11 | H111 | 117.3° | 120.0° |
| N07 | C02 | C03 | 111.4° | 109.2° |
| N07 | C02 | C01 | 107.4° | 109.5° |
| N07 | C02 | H021 | 110.3° | 109.6° |
| C36 | C34 | C32 | 120.6° | 120.2° |
| C34 | C36 | C26 | 119.3° | 120.2° |
| C34 | C36 | H361 | 120.4° | 119.8° |
| C34 | C32 | O33 | 122.4° | 120.0° |
| C34 | C32 | C28 | 119.8° | 119.9° |
| O33 | C32 | C28 | 117.7° | 120.0° |
| C32 | O33 | H331 | 109.5° | 114.0° |
| N11 | C12 | O13 | 122.8° | 120.0° |
| N11 | C12 | C14 | 114.8° | 120.0° |
| C12 | N11 | H111 | 117.3° | 120.0° |
| C36 | C26 | C17 | 115.3° | 119.9° |
| C36 | C26 | C27 | 121.1° | 120.1° |
| C26 | C36 | H361 | 120.3° | 119.9° |
| O04 | C03 | C02 | 114.4° | 109.3° |
| O04 | C03 | H031 | 108.2° | 109.5° |
| O04 | C03 | H032 | 108.2° | 109.6° |
| C32 | C28 | C27 | 120.8° | 119.8° |
| C32 | C28 | C29 | 119.5° | 120.1° |
| C03 | C02 | C01 | 110.3° | 109.5° |
| C03 | C02 | H021 | 109.1° | 109.5° |
| C02 | C03 | H031 | 108.2° | 109.5° |
| C02 | C03 | H032 | 108.2° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.5° | 109.6° |
| O13 | C12 | C14 | 122.4° | 120.0° |
| C12 | C14 | N15 | 109.6° | 109.5° |
| C12 | C14 | H142 | 109.5° | 109.4° |
| C12 | C14 | H141 | 109.4° | 109.5° |
| N15 | C16 | C17 | 107.0° | 109.4° |
| C16 | N15 | C14 | 124.5° | 124.8° |
| C16 | N15 | C19 | 111.7° | 110.4° |
| N15 | C16 | H161 | 126.5° | 125.3° |
| C16 | C17 | C26 | 121.0° | 126.8° |
| C16 | C17 | C18 | 107.5° | 106.4° |
| C17 | C16 | H161 | 126.5° | 125.3° |
| C17 | C26 | C27 | 123.6° | 120.0° |
| C26 | C17 | C18 | 131.5° | 126.9° |
| C26 | C27 | C28 | 118.3° | 119.8° |
| C26 | C27 | H271 | 120.8° | 120.1° |
| C14 | N15 | C19 | 123.7° | 124.8° |
| N15 | C14 | H142 | 109.4° | 109.5° |
| N15 | C14 | H141 | 109.4° | 109.5° |
| C27 | C28 | C29 | 119.7° | 120.2° |
| C28 | C27 | H271 | 120.9° | 120.1° |
| C28 | C29 | N30 | 119.7° | 119.9° |
| C28 | C29 | O31 | 119.1° | 120.0° |
| N30 | C29 | O31 | 121.1° | 120.0° |
| C29 | N30 | H301 | 120.0° | 120.0° |
| C29 | N30 | H302 | 120.0° | 120.0° |
| N15 | C19 | C18 | 107.6° | 107.5° |
| N15 | C19 | N20 | 129.5° | 133.5° |
| C17 | C18 | C19 | 106.2° | 106.3° |
| C17 | C18 | C24 | 134.7° | 134.7° |
| C18 | C19 | N20 | 122.9° | 119.0° |
| C19 | C18 | C24 | 119.1° | 119.0° |
| C19 | N20 | C21 | 118.1° | 121.3° |
| C18 | C24 | O25 | 122.8° | 121.0° |
| C18 | C24 | N22 | 117.0° | 118.1° |
| N20 | C21 | N22 | 119.7° | 122.4° |
| N20 | C21 | H211 | 120.2° | 118.8° |
| O25 | C24 | N22 | 120.2° | 120.9° |
| C24 | N22 | C21 | 123.2° | 120.3° |
| C24 | N22 | C23 | 118.4° | 119.9° |
| C21 | N22 | C23 | 118.4° | 119.9° |
| N22 | C21 | H211 | 120.1° | 118.8° |
| N22 | C23 | H231 | 109.5° | 109.5° |
| N22 | C23 | H233 | 109.5° | 109.5° |
| N22 | C23 | H232 | 109.4° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.4° |
| H011 | C01 | H013 | 109.5° | 109.4° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.5° |
| H051 | C05 | H052 | 109.5° | 109.6° |
| H061 | C06 | H062 | 109.5° | 109.5° |
| H142 | C14 | H141 | 109.5° | 109.5° |
| H231 | C23 | H233 | 109.4° | 109.5° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H233 | C23 | H232 | 109.5° | 109.4° |
| H301 | N30 | H302 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N40 | C39 | C37 | H391 | 180.0° | 179.4° |
| N40 | C39 | C37 | CL38 | 179.6° | 179.7° |
| N40 | C39 | C37 | C10 | 1.7° | 0.3° |
| C39 | N40 | C08 | N07 | 179.8° | 179.7° |
| C39 | N40 | C08 | C09 | 1.4° | 0.6° |
| C39 | C37 | CL38 | C10 | 178.7° | 180.0° |
| C37 | C39 | N40 | C08 | 1.1° | 0.6° |
| C39 | C37 | C10 | C09 | 2.4° | 0.0° |
| C39 | C37 | C10 | N11 | 177.4° | 180.0° |
| CL38 | C37 | C10 | C09 | 178.9° | 180.0° |
| CL38 | C37 | C10 | N11 | 3.9° | 0.0° |
| CL38 | C37 | C39 | H391 | 0.5° | 0.3° |
| N40 | C08 | N07 | C06 | 24.2° | 124.2° |
| N40 | C08 | N07 | C09 | 178.9° | 179.8° |
| N40 | C08 | C09 | C10 | 2.0° | 0.3° |
| N40 | C08 | N07 | C02 | 167.7° | 0.6° |
| N40 | C08 | C09 | H091 | 178.0° | 179.7° |
| C08 | N40 | C39 | H391 | 178.9° | 180.0° |
| CL35 | C34 | C36 | C32 | 180.0° | 179.4° |
| CL35 | C34 | C32 | O33 | 1.9° | 0.3° |
| CL35 | C34 | C36 | C26 | 179.5° | 180.0° |
| CL35 | C34 | C32 | C28 | 179.8° | 179.7° |
| CL35 | C34 | C36 | H361 | 0.4° | 0.6° |
| C37 | C10 | C09 | C08 | 2.5° | 0.0° |
| C37 | C10 | C09 | N11 | 174.7° | 179.9° |
| C37 | C10 | N11 | C12 | 170.1° | 155.5° |
| C37 | C10 | N11 | H111 | 9.9° | 24.3° |
| C37 | C10 | C09 | H091 | 177.5° | 180.0° |
| C10 | C37 | C39 | H391 | 178.3° | 179.7° |
| C06 | C05 | O04 | H051 | 120.0° | 119.9° |
| C06 | C05 | O04 | H052 | 120.0° | 119.9° |
| C05 | C06 | N07 | H061 | 120.1° | 119.9° |
| C05 | C06 | N07 | H062 | 120.1° | 120.0° |
| C05 | C06 | N07 | C08 | 153.7° | 177.6° |
| C05 | C06 | N07 | C02 | 60.9° | 58.7° |
| C06 | C05 | O04 | C03 | 51.4° | 58.7° |
| C06 | C05 | H051 | H052 | 120.1° | 120.1° |
| C05 | C06 | H061 | H062 | 119.7° | 120.1° |
| O04 | C05 | C06 | N07 | 59.0° | 56.8° |
| C05 | O04 | C03 | C02 | 44.1° | 58.7° |
| C05 | O04 | C03 | H031 | 164.9° | 61.2° |
| C05 | O04 | C03 | H032 | 76.6° | 178.7° |
| O04 | C05 | H051 | H052 | 120.1° | 120.1° |
| O04 | C05 | C06 | H061 | 179.1° | 176.7° |
| O04 | C05 | C06 | H062 | 61.0° | 63.1° |
| C06 | N07 | C08 | C02 | 143.5° | 123.6° |
| C06 | N07 | C08 | C09 | 154.7° | 56.0° |
| C06 | N07 | C02 | C03 | 51.4° | 58.6° |
| C06 | N07 | C02 | C01 | 69.4° | 61.3° |
| C06 | N07 | C02 | H021 | 172.6° | 178.6° |
| N07 | C06 | C05 | H051 | 179.0° | 176.8° |
| N07 | C06 | C05 | H052 | 60.9° | 63.1° |
| N07 | C06 | H061 | H062 | 119.7° | 120.1° |
| N07 | C08 | C09 | C10 | 179.2° | 180.0° |
| C08 | N07 | C02 | C03 | 163.8° | 177.6° |
| C08 | N07 | C02 | C01 | 75.4° | 62.5° |
| C08 | N07 | C02 | H021 | 42.6° | 57.7° |
| C08 | N07 | C06 | H061 | 33.6° | 57.7° |
| C08 | N07 | C06 | H062 | 86.2° | 62.5° |
| N07 | C08 | C09 | H091 | 0.8° | 0.0° |
| C08 | C09 | C10 | H091 | 180.0° | 180.0° |
| C08 | C09 | C10 | N11 | 177.2° | 179.9° |
| C09 | C08 | N07 | C02 | 11.2° | 179.7° |
| C09 | C10 | N11 | C12 | 15.1° | 24.4° |
| C09 | C10 | N11 | H111 | 164.8° | 155.8° |
| C10 | N11 | C12 | H111 | 180.0° | 179.8° |
| C10 | N11 | C12 | O13 | 4.3° | 5.5° |
| C10 | N11 | C12 | C14 | 177.3° | 174.5° |
| N11 | C10 | C09 | H091 | 2.8° | 0.0° |
| N07 | C02 | C03 | O04 | 41.8° | 56.8° |
| N07 | C02 | C03 | C01 | 119.1° | 119.9° |
| N07 | C02 | C03 | H021 | 121.9° | 120.0° |
| N07 | C02 | C01 | H021 | 119.1° | 120.2° |
| N07 | C02 | C01 | H011 | 180.0° | 179.8° |
| N07 | C02 | C01 | H012 | 60.0° | 60.3° |
| N07 | C02 | C01 | H013 | 60.0° | 59.8° |
| N07 | C02 | C03 | H031 | 162.5° | 63.1° |
| N07 | C02 | C03 | H032 | 78.9° | 176.8° |
| C02 | N07 | C06 | H061 | 179.0° | 178.6° |
| C02 | N07 | C06 | H062 | 59.2° | 61.3° |
| C36 | C34 | C32 | O33 | 178.1° | 179.7° |
| C34 | C36 | C26 | H361 | 180.0° | 179.4° |
| C36 | C34 | C32 | C28 | 0.3° | 0.4° |
| C34 | C36 | C26 | C17 | 178.7° | 179.7° |
| C34 | C36 | C26 | C27 | 0.2° | 0.5° |
| C34 | C32 | O33 | C28 | 178.4° | 179.9° |
| C32 | C34 | C36 | C26 | 0.5° | 0.6° |
| C34 | C32 | C28 | C27 | 0.3° | 0.0° |
| C34 | C32 | C28 | C29 | 179.0° | 180.0° |
| C32 | C34 | C36 | H361 | 179.5° | 180.0° |
| C34 | C32 | O33 | H331 | 180.0° | 90.0° |
| O33 | C32 | C28 | C27 | 178.7° | 180.0° |
| O33 | C32 | C28 | C29 | 2.6° | 0.1° |
| N11 | C12 | O13 | C14 | 178.3° | 180.0° |
| N11 | C12 | C14 | N15 | 144.4° | 180.0° |
| N11 | C12 | C14 | H142 | 24.4° | 60.0° |
| N11 | C12 | C14 | H141 | 95.5° | 60.0° |
| C36 | C26 | C17 | C16 | 24.2° | 129.8° |
| C36 | C26 | C17 | C27 | 178.8° | 179.8° |
| C36 | C26 | C27 | C28 | 0.3° | 0.2° |
| C36 | C26 | C17 | C18 | 155.4° | 50.2° |
| C36 | C26 | C27 | H271 | 179.7° | 179.7° |
| O04 | C03 | C02 | H031 | 120.7° | 119.9° |
| O04 | C03 | C02 | H032 | 120.7° | 120.0° |
| O04 | C03 | C02 | C01 | 77.3° | 63.1° |
| O04 | C03 | C02 | H021 | 163.7° | 176.8° |
| O04 | C03 | H031 | H032 | 117.7° | 120.1° |
| C03 | O04 | C05 | H051 | 171.4° | 178.6° |
| C03 | O04 | C05 | H052 | 68.6° | 61.2° |
| C32 | C28 | C27 | C26 | 0.6° | 0.0° |
| C32 | C28 | C27 | C29 | 178.7° | 180.0° |
| C32 | C28 | C29 | N30 | 3.3° | 180.0° |
| C32 | C28 | C29 | O31 | 173.4° | 0.0° |
| C32 | C28 | C27 | H271 | 179.4° | 180.0° |
| C28 | C32 | O33 | H331 | 1.6° | 90.1° |
| C03 | C02 | C01 | H021 | 119.4° | 120.1° |
| C03 | C02 | C01 | H011 | 58.5° | 60.0° |
| C03 | C02 | C01 | H012 | 178.5° | 180.0° |
| C03 | C02 | C01 | H013 | 61.5° | 60.0° |
| C02 | C03 | H031 | H032 | 117.8° | 120.1° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.1° |
| C02 | C01 | H012 | H013 | 120.0° | 120.1° |
| C01 | C02 | C03 | H031 | 43.4° | 177.0° |
| C01 | C02 | C03 | H032 | 162.0° | 56.9° |
| O13 | C12 | C14 | N15 | 33.9° | 0.0° |
| O13 | C12 | N11 | H111 | 175.7° | 174.3° |
| O13 | C12 | C14 | H142 | 153.9° | 120.0° |
| O13 | C12 | C14 | H141 | 86.1° | 120.0° |
| C12 | C14 | N15 | C16 | 83.8° | 95.0° |
| C12 | C14 | N15 | H142 | 120.0° | 120.0° |
| C12 | C14 | N15 | H141 | 120.0° | 120.0° |
| C12 | C14 | N15 | C19 | 95.4° | 85.0° |
| C14 | C12 | N11 | H111 | 2.7° | 5.7° |
| C12 | C14 | H142 | H141 | 120.0° | 120.0° |
| N15 | C16 | C17 | H161 | 180.0° | 179.7° |
| N15 | C16 | C17 | C26 | 179.9° | 180.0° |
| C16 | N15 | C14 | C19 | 179.2° | 179.9° |
| N15 | C16 | C17 | C18 | 0.4° | 0.0° |
| C16 | N15 | C19 | C18 | 0.3° | 0.0° |
| C16 | N15 | C19 | N20 | 179.3° | 180.0° |
| C16 | N15 | C14 | H142 | 36.2° | 145.0° |
| C16 | N15 | C14 | H141 | 156.2° | 25.0° |
| C16 | C17 | C26 | C18 | 179.6° | 180.0° |
| C16 | C17 | C26 | C27 | 154.6° | 50.0° |
| C17 | C16 | N15 | C14 | 179.7° | 179.9° |
| C17 | C16 | N15 | C19 | 0.5° | 0.0° |
| C16 | C17 | C18 | C19 | 0.2° | 0.0° |
| C16 | C17 | C18 | C24 | 179.8° | 179.9° |
| C17 | C26 | C27 | C28 | 179.1° | 180.0° |
| C26 | C17 | C18 | C19 | 179.9° | 180.0° |
| C26 | C17 | C18 | C24 | 0.1° | 0.1° |
| C26 | C17 | C16 | H161 | 0.1° | 0.3° |
| C17 | C26 | C27 | H271 | 0.9° | 0.1° |
| C17 | C26 | C36 | H361 | 1.3° | 0.2° |
| C26 | C27 | C28 | H271 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 179.3° | 179.9° |
| C27 | C26 | C17 | C18 | 25.8° | 130.0° |
| C27 | C26 | C36 | H361 | 179.8° | 180.0° |
| C14 | N15 | C19 | C18 | 179.6° | 179.9° |
| C14 | N15 | C19 | N20 | 0.0° | 0.1° |
| N15 | C14 | H142 | H141 | 119.9° | 120.0° |
| C14 | N15 | C16 | H161 | 0.3° | 0.3° |
| C27 | C28 | C29 | N30 | 178.0° | 0.0° |
| C27 | C28 | C29 | O31 | 5.3° | 180.0° |
| C28 | C29 | N30 | O31 | 176.6° | 180.0° |
| C29 | C28 | C27 | H271 | 0.7° | 0.0° |
| C28 | C29 | N30 | H301 | 176.6° | 0.0° |
| C28 | C29 | N30 | H302 | 3.4° | 180.0° |
| C29 | N30 | H301 | H302 | 180.0° | 180.0° |
| N15 | C19 | C18 | C17 | 0.0° | 0.0° |
| N15 | C19 | C18 | N20 | 179.6° | 180.0° |
| N15 | C19 | C18 | C24 | 179.9° | 179.9° |
| N15 | C19 | N20 | C21 | 179.8° | 180.0° |
| C19 | N15 | C14 | H142 | 144.6° | 35.0° |
| C19 | N15 | C14 | H141 | 24.6° | 155.0° |
| C19 | N15 | C16 | H161 | 179.6° | 179.7° |
| C17 | C18 | C19 | C24 | 180.0° | 179.9° |
| C17 | C18 | C19 | N20 | 179.6° | 180.0° |
| C17 | C18 | C24 | O25 | 0.6° | 0.1° |
| C17 | C18 | C24 | N22 | 179.9° | 180.0° |
| C18 | C17 | C16 | H161 | 179.6° | 179.7° |
| O31 | C29 | N30 | H301 | 0.0° | 180.0° |
| O31 | C29 | N30 | H302 | 180.0° | 0.0° |
| C18 | C19 | N20 | C21 | 0.7° | 0.0° |
| C19 | C18 | C24 | O25 | 179.3° | 180.0° |
| C19 | C18 | C24 | N22 | 0.0° | 0.1° |
| N20 | C19 | C18 | C24 | 0.4° | 0.0° |
| C19 | N20 | C21 | N22 | 0.5° | 0.1° |
| C19 | N20 | C21 | H211 | 179.5° | 180.0° |
| C18 | C24 | O25 | N22 | 179.3° | 179.9° |
| C18 | C24 | N22 | C21 | 0.2° | 0.0° |
| C18 | C24 | N22 | C23 | 179.7° | 179.9° |
| N20 | C21 | N22 | C24 | 0.1° | 0.0° |
| N20 | C21 | N22 | H211 | 180.0° | 179.9° |
| N20 | C21 | N22 | C23 | 180.0° | 180.0° |
| O25 | C24 | N22 | C21 | 179.5° | 180.0° |
| O25 | C24 | N22 | C23 | 0.4° | 0.0° |
| C24 | N22 | C21 | C23 | 179.9° | 180.0° |
| C24 | N22 | C21 | H211 | 179.9° | 180.0° |
| C24 | N22 | C23 | H231 | 180.0° | 180.0° |
| C24 | N22 | C23 | H233 | 60.0° | 60.0° |
| C24 | N22 | C23 | H232 | 60.0° | 59.9° |
| C21 | N22 | C23 | H231 | 0.1° | 0.0° |
| C21 | N22 | C23 | H233 | 120.1° | 120.0° |
| C21 | N22 | C23 | H232 | 119.9° | 120.0° |
| C23 | N22 | C21 | H211 | 0.0° | 0.0° |
| N22 | C23 | H231 | H233 | 120.0° | 120.0° |
| N22 | C23 | H231 | H232 | 120.0° | 120.1° |
| N22 | C23 | H233 | H232 | 120.0° | 120.0° |
| H011 | C01 | H012 | H013 | 120.0° | 119.9° |
| H011 | C01 | C02 | H021 | 60.9° | 60.0° |
| H012 | C01 | C02 | H021 | 59.2° | 59.9° |
| H013 | C01 | C02 | H021 | 179.1° | 179.9° |
| H021 | C02 | C03 | H031 | 75.6° | 56.9° |
| H021 | C02 | C03 | H032 | 43.0° | 63.2° |
| H051 | C05 | C06 | H061 | 60.9° | 63.3° |
| H051 | C05 | C06 | H062 | 58.9° | 56.8° |
| H052 | C05 | C06 | H061 | 59.1° | 56.8° |
| H052 | C05 | C06 | H062 | 179.0° | 177.0° |
| H231 | C23 | H233 | H232 | 120.0° | 120.0° |
