7ST
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C42 | N41 | sing | 1.47Å | 1.45Å | |
| N41 | N40 | sing | 1.40Å | 1.37Å | Aromatic |
| N41 | C43 | sing | 1.35Å | 1.30Å | Aromatic |
| N40 | C39 | doub | 1.31Å | 1.33Å | Aromatic |
| C43 | C38 | doub | 1.37Å | 1.38Å | Aromatic |
| C39 | C38 | sing | 1.41Å | 1.39Å | Aromatic |
| C38 | C37 | sing | 1.43Å | 1.47Å | |
| C37 | C36 | trip | 1.17Å | 1.16Å | |
| C36 | C35 | sing | 1.47Å | 1.49Å | |
| C35 | N34 | sing | 1.46Å | 1.43Å | |
| N34 | C33 | sing | 1.36Å | 1.41Å | |
| N34 | C44 | sing | 1.35Å | 1.41Å | |
| C33 | N32 | doub | 1.30Å | 1.41Å | |
| O45 | C44 | doub | 1.22Å | 1.17Å | |
| C44 | C46 | sing | 1.41Å | 1.50Å | |
| N32 | C31 | sing | 1.34Å | 1.45Å | |
| C46 | C31 | doub | 1.40Å | 1.38Å | Aromatic |
| C46 | C11 | sing | 1.47Å | 1.40Å | Aromatic |
| C31 | N13 | sing | 1.36Å | 1.32Å | Aromatic |
| N08 | C07 | trip | 1.14Å | 1.11Å | |
| C07 | C06 | sing | 1.43Å | 1.49Å | |
| C05 | C06 | doub | 1.40Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.39Å | 1.36Å | Aromatic |
| N13 | C14 | sing | 1.47Å | 1.43Å | |
| N13 | C12 | sing | 1.37Å | 1.31Å | Aromatic |
| C11 | C04 | sing | 1.48Å | 1.40Å | |
| C11 | C12 | doub | 1.36Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.50Å | |
| C06 | C09 | sing | 1.40Å | 1.40Å | Aromatic |
| O16 | C15 | doub | 1.21Å | 1.18Å | |
| C04 | C03 | doub | 1.40Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C29 | O28 | sing | 1.43Å | 1.40Å | |
| C15 | N17 | sing | 1.35Å | 1.43Å | |
| C30 | N25 | sing | 1.47Å | 1.46Å | |
| O28 | C27 | sing | 1.43Å | 1.38Å | |
| C09 | O10 | sing | 1.36Å | 1.42Å | |
| C09 | C02 | doub | 1.39Å | 1.41Å | Aromatic |
| C03 | C02 | sing | 1.38Å | 1.40Å | Aromatic |
| N17 | C18 | sing | 1.40Å | 1.47Å | |
| C19 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| N25 | C20 | sing | 1.39Å | 1.47Å | |
| N25 | C26 | sing | 1.47Å | 1.46Å | |
| C02 | C01 | sing | 1.51Å | 1.51Å | |
| C18 | C23 | sing | 1.40Å | 1.40Å | Aromatic |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C20 | N21 | doub | 1.32Å | 1.33Å | Aromatic |
| C23 | CL24 | sing | 1.74Å | 1.79Å | |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| N21 | C22 | sing | 1.32Å | 1.35Å | Aromatic |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| O10 | H101 | sing | 0.97Å | 0.95Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| N17 | H171 | sing | 0.97Å | 1.00Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | 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 | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| C42 | H423 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C43 | H431 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C42 | N41 | N40 | 125.5° | 125.8° |
| C42 | N41 | C43 | 124.1° | 125.9° |
| N41 | C42 | H423 | 109.5° | 109.4° |
| N41 | C42 | H422 | 109.5° | 109.4° |
| N41 | C42 | H421 | 109.5° | 109.5° |
| N40 | N41 | C43 | 110.3° | 108.3° |
| N41 | N40 | C39 | 108.5° | 108.6° |
| N41 | C43 | C38 | 106.8° | 107.6° |
| N41 | C43 | H431 | 126.6° | 126.2° |
| N40 | C39 | C38 | 105.9° | 108.1° |
| N40 | C39 | H391 | 127.0° | 125.9° |
| C43 | C38 | C39 | 108.4° | 107.5° |
| C43 | C38 | C37 | 124.7° | 126.2° |
| C38 | C43 | H431 | 126.6° | 126.2° |
| C39 | C38 | C37 | 126.9° | 126.3° |
| C38 | C39 | H391 | 127.0° | 126.0° |
| C38 | C37 | C36 | 178.5° | 180.0° |
| C37 | C36 | C35 | 178.1° | 180.0° |
| C36 | C35 | N34 | 125.8° | 109.5° |
| C36 | C35 | H352 | 105.2° | 109.5° |
| C36 | C35 | H351 | 105.2° | 109.4° |
| C35 | N34 | C33 | 116.3° | 119.9° |
| C35 | N34 | C44 | 120.1° | 119.9° |
| N34 | C35 | H352 | 105.3° | 109.5° |
| N34 | C35 | H351 | 105.3° | 109.5° |
| C33 | N34 | C44 | 123.3° | 120.2° |
| N34 | C33 | N32 | 120.9° | 122.4° |
| N34 | C33 | H331 | 119.6° | 118.8° |
| N34 | C44 | O45 | 116.8° | 120.9° |
| N34 | C44 | C46 | 116.8° | 118.1° |
| C33 | N32 | C31 | 116.5° | 121.3° |
| N32 | C33 | H331 | 119.5° | 118.8° |
| O45 | C44 | C46 | 126.4° | 121.0° |
| C44 | C46 | C31 | 117.8° | 119.0° |
| C44 | C46 | C11 | 136.2° | 134.7° |
| N32 | C31 | C46 | 124.7° | 119.0° |
| N32 | C31 | N13 | 125.9° | 133.5° |
| C31 | C46 | C11 | 105.9° | 106.3° |
| C46 | C31 | N13 | 109.4° | 107.5° |
| C46 | C11 | C04 | 131.8° | 126.8° |
| C46 | C11 | C12 | 105.2° | 106.4° |
| C31 | N13 | C14 | 126.1° | 124.8° |
| C31 | N13 | C12 | 109.2° | 110.4° |
| N08 | C07 | C06 | 179.3° | 180.0° |
| C07 | C06 | C05 | 112.8° | 120.1° |
| C07 | C06 | C09 | 121.5° | 120.1° |
| C06 | C05 | C04 | 117.8° | 119.8° |
| C05 | C06 | C09 | 125.7° | 119.7° |
| C06 | C05 | H051 | 121.1° | 120.1° |
| C05 | C04 | C11 | 122.4° | 120.0° |
| C05 | C04 | C03 | 119.2° | 120.0° |
| C04 | C05 | H051 | 121.1° | 120.1° |
| C14 | N13 | C12 | 124.7° | 124.8° |
| N13 | C14 | C15 | 110.9° | 109.4° |
| N13 | C14 | H141 | 109.1° | 109.5° |
| N13 | C14 | H142 | 109.1° | 109.5° |
| N13 | C12 | C11 | 110.2° | 109.4° |
| N13 | C12 | H121 | 124.9° | 125.3° |
| C04 | C11 | C12 | 123.0° | 126.8° |
| C11 | C04 | C03 | 118.2° | 120.0° |
| C11 | C12 | H121 | 124.9° | 125.2° |
| C14 | C15 | O16 | 122.3° | 120.0° |
| C14 | C15 | N17 | 114.6° | 120.0° |
| C15 | C14 | H141 | 109.1° | 109.5° |
| C15 | C14 | H142 | 109.1° | 109.4° |
| C06 | C09 | O10 | 120.1° | 120.0° |
| C06 | C09 | C02 | 115.6° | 119.9° |
| O16 | C15 | N17 | 123.1° | 120.0° |
| C04 | C03 | C02 | 122.6° | 120.2° |
| C04 | C03 | H031 | 118.7° | 119.9° |
| C30 | C29 | O28 | 116.6° | 109.3° |
| C29 | C30 | N25 | 113.1° | 109.2° |
| C30 | C29 | H291 | 107.7° | 109.5° |
| C30 | C29 | H292 | 107.6° | 109.5° |
| C29 | C30 | H302 | 108.6° | 109.5° |
| C29 | C30 | H301 | 108.6° | 109.5° |
| C29 | O28 | C27 | 115.4° | 113.7° |
| O28 | C29 | H291 | 107.7° | 109.5° |
| O28 | C29 | H292 | 107.7° | 109.5° |
| C15 | N17 | C18 | 124.6° | 120.0° |
| C15 | N17 | H171 | 117.7° | 120.0° |
| C30 | N25 | C20 | 123.4° | 111.0° |
| C30 | N25 | C26 | 108.5° | 110.7° |
| N25 | C30 | H302 | 108.6° | 109.5° |
| N25 | C30 | H301 | 108.5° | 109.5° |
| O28 | C27 | C26 | 111.6° | 109.2° |
| O28 | C27 | H272 | 109.0° | 109.5° |
| O28 | C27 | H271 | 108.9° | 109.6° |
| O10 | C09 | C02 | 124.3° | 120.1° |
| C09 | O10 | H101 | 109.5° | 114.0° |
| C09 | C02 | C03 | 119.1° | 120.3° |
| C09 | C02 | C01 | 125.3° | 119.8° |
| C03 | C02 | C01 | 115.7° | 119.9° |
| C02 | C03 | H031 | 118.7° | 119.9° |
| N17 | C18 | C19 | 124.6° | 120.8° |
| N17 | C18 | C23 | 117.8° | 120.8° |
| C18 | N17 | H171 | 117.7° | 120.0° |
| C18 | C19 | C20 | 120.3° | 119.0° |
| C19 | C18 | C23 | 117.6° | 118.4° |
| C18 | C19 | H191 | 119.9° | 120.5° |
| C19 | C20 | N25 | 119.4° | 119.6° |
| C19 | C20 | N21 | 119.6° | 120.7° |
| C20 | C19 | H191 | 119.8° | 120.5° |
| C20 | N25 | C26 | 124.0° | 111.0° |
| N25 | C20 | N21 | 121.0° | 119.7° |
| N25 | C26 | C27 | 113.0° | 109.3° |
| N25 | C26 | H261 | 108.6° | 109.5° |
| N25 | C26 | H262 | 108.6° | 109.6° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C18 | C23 | CL24 | 119.4° | 120.4° |
| C18 | C23 | C22 | 120.3° | 119.2° |
| C27 | C26 | H261 | 108.6° | 109.5° |
| C27 | C26 | H262 | 108.6° | 109.5° |
| C26 | C27 | H272 | 108.9° | 109.5° |
| C26 | C27 | H271 | 109.0° | 109.5° |
| C20 | N21 | C22 | 122.7° | 121.8° |
| CL24 | C23 | C22 | 120.3° | 120.4° |
| C23 | C22 | N21 | 119.4° | 120.9° |
| C23 | C22 | H221 | 120.3° | 119.6° |
| N21 | C22 | H221 | 120.3° | 119.5° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H261 | C26 | H262 | 109.5° | 109.5° |
| H272 | C27 | H271 | 109.4° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H302 | C30 | H301 | 109.5° | 109.6° |
| H352 | C35 | H351 | 109.4° | 109.5° |
| H423 | C42 | H422 | 109.5° | 109.5° |
| H423 | C42 | H421 | 109.5° | 109.5° |
| H422 | C42 | H421 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C42 | N41 | N40 | C43 | 175.4° | 179.7° |
| C42 | N41 | N40 | C39 | 179.1° | 180.0° |
| C42 | N41 | C43 | C38 | 179.3° | 179.8° |
| N41 | C42 | H423 | H422 | 120.0° | 119.9° |
| N41 | C42 | H423 | H421 | 120.0° | 120.0° |
| N41 | C42 | H422 | H421 | 120.0° | 120.0° |
| C42 | N41 | C43 | H431 | 0.7° | 0.3° |
| N40 | N41 | C43 | C38 | 3.8° | 0.5° |
| N41 | N40 | C39 | C38 | 2.0° | 0.1° |
| N41 | N40 | C39 | H391 | 178.0° | 180.0° |
| N40 | N41 | C42 | H423 | 0.0° | 90.0° |
| N40 | N41 | C42 | H422 | 120.0° | 150.1° |
| N40 | N41 | C42 | H421 | 120.0° | 30.0° |
| N40 | N41 | C43 | H431 | 176.1° | 180.0° |
| C43 | N41 | N40 | C39 | 3.7° | 0.3° |
| N41 | C43 | C38 | H431 | 180.0° | 179.5° |
| N41 | C43 | C38 | C39 | 2.6° | 0.4° |
| N41 | C43 | C38 | C37 | 179.9° | 179.8° |
| C43 | N41 | C42 | H423 | 174.8° | 89.7° |
| C43 | N41 | C42 | H422 | 65.2° | 30.3° |
| C43 | N41 | C42 | H421 | 54.8° | 150.3° |
| N40 | C39 | C38 | C43 | 0.3° | 0.2° |
| N40 | C39 | C38 | H391 | 180.0° | 179.9° |
| N40 | C39 | C38 | C37 | 177.8° | 180.0° |
| C43 | C38 | C39 | C37 | 177.5° | 179.8° |
| C43 | C38 | C37 | C36 | 97.0° | 129.1° |
| C43 | C38 | C39 | H391 | 179.7° | 179.7° |
| C39 | C38 | C37 | C36 | 80.1° | 50.7° |
| C39 | C38 | C43 | H431 | 177.4° | 179.9° |
| C38 | C37 | C36 | C35 | 6.0° | 169.9° |
| C37 | C38 | C39 | H391 | 2.2° | 0.1° |
| C37 | C38 | C43 | H431 | 0.2° | 0.3° |
| C37 | C36 | C35 | N34 | 174.4° | 40.6° |
| C37 | C36 | C35 | H352 | 63.4° | 79.5° |
| C37 | C36 | C35 | H351 | 52.2° | 160.6° |
| C36 | C35 | N34 | H352 | 122.2° | 120.0° |
| C36 | C35 | N34 | H351 | 122.2° | 120.0° |
| C36 | C35 | N34 | C33 | 92.8° | 90.0° |
| C36 | C35 | N34 | C44 | 92.9° | 90.0° |
| C36 | C35 | H352 | H351 | 112.7° | 120.0° |
| C35 | N34 | C33 | C44 | 174.2° | 180.0° |
| C35 | N34 | C33 | N32 | 176.4° | 180.0° |
| C35 | N34 | C44 | O45 | 6.7° | 0.0° |
| C35 | N34 | C44 | C46 | 176.6° | 179.8° |
| C35 | N34 | C33 | H331 | 3.6° | 0.0° |
| N34 | C35 | H352 | H351 | 112.7° | 120.0° |
| N34 | C33 | N32 | H331 | 180.0° | 180.0° |
| C33 | N34 | C44 | O45 | 179.4° | 180.0° |
| C33 | N34 | C44 | C46 | 2.7° | 0.2° |
| N34 | C33 | N32 | C31 | 1.6° | 0.1° |
| C33 | N34 | C35 | H352 | 145.0° | 150.0° |
| C33 | N34 | C35 | H351 | 29.4° | 30.0° |
| C44 | N34 | C33 | N32 | 2.2° | 0.0° |
| N34 | C44 | O45 | C46 | 176.4° | 179.8° |
| N34 | C44 | C46 | C31 | 2.7° | 0.5° |
| N34 | C44 | C46 | C11 | 178.4° | 179.5° |
| C44 | N34 | C33 | H331 | 177.8° | 180.0° |
| C44 | N34 | C35 | H352 | 29.3° | 30.0° |
| C44 | N34 | C35 | H351 | 144.9° | 150.0° |
| C33 | N32 | C31 | C46 | 1.9° | 0.3° |
| C33 | N32 | C31 | N13 | 179.7° | 180.0° |
| O45 | C44 | C46 | C31 | 179.1° | 179.7° |
| O45 | C44 | C46 | C11 | 5.2° | 0.7° |
| C44 | C46 | C31 | N32 | 2.4° | 0.6° |
| C44 | C46 | C31 | C11 | 176.9° | 179.3° |
| C44 | C46 | C31 | N13 | 178.9° | 179.7° |
| C44 | C46 | C11 | C04 | 5.1° | 0.8° |
| C44 | C46 | C11 | C12 | 177.9° | 179.6° |
| N32 | C31 | C46 | N13 | 178.7° | 179.7° |
| N32 | C31 | C46 | C11 | 179.3° | 179.8° |
| N32 | C31 | N13 | C14 | 0.5° | 0.0° |
| N32 | C31 | N13 | C12 | 180.0° | 179.9° |
| C31 | N32 | C33 | H331 | 178.4° | 180.0° |
| C46 | C31 | N13 | C14 | 178.2° | 179.7° |
| C46 | C31 | N13 | C12 | 1.4° | 0.3° |
| C31 | C46 | C11 | C04 | 178.9° | 179.9° |
| C31 | C46 | C11 | C12 | 1.8° | 0.4° |
| C11 | C46 | C31 | N13 | 2.0° | 0.4° |
| C46 | C11 | C04 | C05 | 31.9° | 50.4° |
| C46 | C11 | C12 | N13 | 1.1° | 0.3° |
| C46 | C11 | C04 | C12 | 176.6° | 179.6° |
| C46 | C11 | C04 | C03 | 153.2° | 129.7° |
| C46 | C11 | C12 | H121 | 178.9° | 179.8° |
| C31 | N13 | C14 | C12 | 179.5° | 179.9° |
| C31 | N13 | C12 | C11 | 0.2° | 0.0° |
| C31 | N13 | C14 | C15 | 92.5° | 85.0° |
| C31 | N13 | C12 | H121 | 179.8° | 180.0° |
| C31 | N13 | C14 | H141 | 27.7° | 155.0° |
| C31 | N13 | C14 | H142 | 147.2° | 34.9° |
| N08 | C07 | C06 | C05 | 66.4° | 143.2° |
| N08 | C07 | C06 | C09 | 115.2° | 36.5° |
| C07 | C06 | C05 | C09 | 178.3° | 179.7° |
| C07 | C06 | C05 | C04 | 177.7° | 180.0° |
| C07 | C06 | C09 | O10 | 1.2° | 0.3° |
| C07 | C06 | C09 | C02 | 179.2° | 179.7° |
| C07 | C06 | C05 | H051 | 2.3° | 0.3° |
| C06 | C05 | C04 | H051 | 180.0° | 179.7° |
| C06 | C05 | C04 | C11 | 177.2° | 179.9° |
| C06 | C05 | C04 | C03 | 2.4° | 0.0° |
| C05 | C06 | C09 | O10 | 179.3° | 180.0° |
| C05 | C06 | C09 | C02 | 1.0° | 0.5° |
| C05 | C04 | C11 | C03 | 174.9° | 179.9° |
| C05 | C04 | C11 | C12 | 144.7° | 130.1° |
| C04 | C05 | C06 | C09 | 0.6° | 0.3° |
| C05 | C04 | C03 | C02 | 2.6° | 0.1° |
| C05 | C04 | C03 | H031 | 177.4° | 180.0° |
| C14 | N13 | C12 | C11 | 179.4° | 180.0° |
| N13 | C14 | C15 | H141 | 120.2° | 120.1° |
| N13 | C14 | C15 | H142 | 120.2° | 120.0° |
| N13 | C14 | C15 | O16 | 38.6° | 0.1° |
| N13 | C14 | C15 | N17 | 141.0° | 180.0° |
| C14 | N13 | C12 | H121 | 0.6° | 0.1° |
| N13 | C14 | H141 | H142 | 119.3° | 120.0° |
| N13 | C12 | C11 | C04 | 178.5° | 179.9° |
| N13 | C12 | C11 | H121 | 180.0° | 180.0° |
| C12 | N13 | C14 | C15 | 88.0° | 95.1° |
| C12 | N13 | C14 | H141 | 151.8° | 24.9° |
| C12 | N13 | C14 | H142 | 32.3° | 145.0° |
| C11 | C04 | C03 | C02 | 177.6° | 180.0° |
| C11 | C04 | C03 | H031 | 2.4° | 0.1° |
| C11 | C04 | C05 | H051 | 2.8° | 0.3° |
| C04 | C11 | C12 | H121 | 1.6° | 0.1° |
| C12 | C11 | C04 | C03 | 30.2° | 49.9° |
| C14 | C15 | O16 | N17 | 179.5° | 179.9° |
| C14 | C15 | N17 | C18 | 179.8° | 174.4° |
| C15 | C14 | H141 | H142 | 119.3° | 120.0° |
| C14 | C15 | N17 | H171 | 0.2° | 5.6° |
| C06 | C09 | O10 | C02 | 179.6° | 179.5° |
| C06 | C09 | C02 | C03 | 0.9° | 0.5° |
| C06 | C09 | C02 | C01 | 179.3° | 179.7° |
| C09 | C06 | C05 | H051 | 179.4° | 180.0° |
| C06 | C09 | O10 | H101 | 180.0° | 90.0° |
| O16 | C15 | N17 | C18 | 0.6° | 5.7° |
| O16 | C15 | C14 | H141 | 81.7° | 120.0° |
| O16 | C15 | C14 | H142 | 158.8° | 120.0° |
| O16 | C15 | N17 | H171 | 179.4° | 174.3° |
| C04 | C03 | C02 | C09 | 0.9° | 0.2° |
| C04 | C03 | C02 | H031 | 180.0° | 179.9° |
| C04 | C03 | C02 | C01 | 179.0° | 180.0° |
| C03 | C04 | C05 | H051 | 177.6° | 179.7° |
| C30 | C29 | O28 | H291 | 121.0° | 120.0° |
| C30 | C29 | O28 | H292 | 121.0° | 120.0° |
| C29 | C30 | N25 | H302 | 120.6° | 120.0° |
| C29 | C30 | N25 | H301 | 120.6° | 119.9° |
| C30 | C29 | O28 | C27 | 42.0° | 58.7° |
| C29 | C30 | N25 | C20 | 153.7° | 177.6° |
| C29 | C30 | N25 | C26 | 48.6° | 58.7° |
| C30 | C29 | H291 | H292 | 116.7° | 120.1° |
| C29 | C30 | H302 | H301 | 118.3° | 120.1° |
| O28 | C29 | C30 | N25 | 42.2° | 56.9° |
| C29 | O28 | C27 | C26 | 48.1° | 58.7° |
| C29 | O28 | C27 | H272 | 168.4° | 61.2° |
| C29 | O28 | C27 | H271 | 72.3° | 178.6° |
| O28 | C29 | H291 | H292 | 116.8° | 120.1° |
| O28 | C29 | C30 | H302 | 162.8° | 63.1° |
| O28 | C29 | C30 | H301 | 78.3° | 176.8° |
| C15 | N17 | C18 | H171 | 180.0° | 180.0° |
| C15 | N17 | C18 | C19 | 17.2° | 24.5° |
| C15 | N17 | C18 | C23 | 164.3° | 155.2° |
| N17 | C15 | C14 | H141 | 98.8° | 60.0° |
| N17 | C15 | C14 | H142 | 20.8° | 60.0° |
| C30 | N25 | C20 | C19 | 30.7° | 56.4° |
| C30 | N25 | C20 | C26 | 154.4° | 123.6° |
| C30 | N25 | C26 | C27 | 57.1° | 58.7° |
| C30 | N25 | C20 | N21 | 148.3° | 123.6° |
| C30 | N25 | C26 | H261 | 177.6° | 178.6° |
| C30 | N25 | C26 | H262 | 63.4° | 61.4° |
| N25 | C30 | C29 | H291 | 163.3° | 63.1° |
| N25 | C30 | C29 | H292 | 78.8° | 176.8° |
| N25 | C30 | H302 | H301 | 118.3° | 120.1° |
| O28 | C27 | C26 | N25 | 57.6° | 56.9° |
| O28 | C27 | C26 | H272 | 120.3° | 119.9° |
| O28 | C27 | C26 | H271 | 120.3° | 120.0° |
| O28 | C27 | C26 | H261 | 178.1° | 176.8° |
| O28 | C27 | C26 | H262 | 62.9° | 63.1° |
| O28 | C27 | H272 | H271 | 119.0° | 120.2° |
| C27 | O28 | C29 | H291 | 163.0° | 61.3° |
| C27 | O28 | C29 | H292 | 79.1° | 178.7° |
| O10 | C09 | C02 | C03 | 179.5° | 180.0° |
| O10 | C09 | C02 | C01 | 0.3° | 0.3° |
| C09 | C02 | C03 | C01 | 179.9° | 179.8° |
| C09 | C02 | C01 | H011 | 89.9° | 90.3° |
| C09 | C02 | C01 | H012 | 150.1° | 29.7° |
| C09 | C02 | C01 | H013 | 30.1° | 149.7° |
| C09 | C02 | C03 | H031 | 179.1° | 179.7° |
| C02 | C09 | O10 | H101 | 0.5° | 90.5° |
| C03 | C02 | C01 | H011 | 89.9° | 89.9° |
| C03 | C02 | C01 | H012 | 30.0° | 150.0° |
| C03 | C02 | C01 | H013 | 150.0° | 30.1° |
| N17 | C18 | C19 | C23 | 178.5° | 179.7° |
| N17 | C18 | C19 | C20 | 179.1° | 180.0° |
| N17 | C18 | C23 | CL24 | 0.9° | 0.1° |
| N17 | C18 | C23 | C22 | 179.4° | 179.8° |
| N17 | C18 | C19 | H191 | 0.9° | 0.1° |
| C18 | C19 | C20 | H191 | 180.0° | 180.0° |
| C18 | C19 | C20 | N25 | 179.3° | 180.0° |
| C18 | C19 | C20 | N21 | 0.3° | 0.0° |
| C19 | C18 | C23 | CL24 | 179.5° | 179.8° |
| C19 | C18 | C23 | C22 | 0.9° | 0.5° |
| C19 | C18 | N17 | H171 | 162.8° | 155.5° |
| C19 | C20 | N25 | N21 | 179.0° | 180.0° |
| C19 | C20 | N25 | C26 | 123.6° | 179.9° |
| C20 | C19 | C18 | C23 | 0.6° | 0.3° |
| C19 | C20 | N21 | C22 | 0.2° | 0.0° |
| C20 | N25 | C26 | C27 | 145.3° | 177.6° |
| N25 | C20 | N21 | C22 | 179.2° | 180.0° |
| N25 | C20 | C19 | H191 | 0.7° | 0.0° |
| C20 | N25 | C26 | H261 | 24.8° | 57.7° |
| C20 | N25 | C26 | H262 | 94.2° | 62.4° |
| C20 | N25 | C30 | H302 | 33.1° | 62.4° |
| C20 | N25 | C30 | H301 | 85.8° | 57.7° |
| N25 | C26 | C27 | H261 | 120.5° | 119.9° |
| N25 | C26 | C27 | H262 | 120.5° | 120.0° |
| C26 | N25 | C20 | N21 | 57.4° | 0.0° |
| N25 | C26 | H261 | H262 | 118.4° | 120.1° |
| N25 | C26 | C27 | H272 | 178.0° | 63.0° |
| N25 | C26 | C27 | H271 | 62.7° | 176.9° |
| C26 | N25 | C30 | H302 | 169.1° | 61.3° |
| C26 | N25 | C30 | H301 | 72.0° | 178.5° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C01 | C02 | C03 | H031 | 1.0° | 0.1° |
| C18 | C23 | CL24 | C22 | 179.7° | 179.7° |
| C18 | C23 | C22 | N21 | 0.8° | 0.5° |
| C23 | C18 | N17 | H171 | 15.7° | 24.8° |
| C23 | C18 | C19 | H191 | 179.4° | 179.8° |
| C18 | C23 | C22 | H221 | 179.2° | 179.7° |
| C27 | C26 | H261 | H262 | 118.4° | 120.1° |
| C26 | C27 | H272 | H271 | 119.0° | 120.0° |
| C20 | N21 | C22 | C23 | 0.4° | 0.2° |
| N21 | C20 | C19 | H191 | 179.7° | 180.0° |
| C20 | N21 | C22 | H221 | 179.6° | 180.0° |
| CL24 | C23 | C22 | N21 | 179.6° | 179.8° |
| CL24 | C23 | C22 | H221 | 0.4° | 0.0° |
| C23 | C22 | N21 | H221 | 180.0° | 179.8° |
| H011 | C01 | H012 | H013 | 120.0° | 120.0° |
| H261 | C26 | C27 | H272 | 61.5° | 56.8° |
| H261 | C26 | C27 | H271 | 57.8° | 63.2° |
| H262 | C26 | C27 | H272 | 57.4° | 176.9° |
| H262 | C26 | C27 | H271 | 176.7° | 56.9° |
| H291 | C29 | C30 | H302 | 76.2° | 176.9° |
| H291 | C29 | C30 | H301 | 42.7° | 56.8° |
| H292 | C29 | C30 | H302 | 41.7° | 56.9° |
| H292 | C29 | C30 | H301 | 160.7° | 63.3° |
| H423 | C42 | H422 | H421 | 120.0° | 120.1° |
