8J9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C32 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C04 | C03 | sing | 1.53Å | 1.53Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C33 | C28 | sing | 1.38Å | 1.37Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| N21 | C05 | sing | 1.47Å | 1.48Å | |
| N21 | C22 | sing | 1.47Å | 1.45Å | |
| C26 | C22 | sing | 1.53Å | 1.53Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| O24 | C23 | doub | 1.21Å | 1.30Å | |
| C05 | C06 | sing | 1.51Å | 1.52Å | |
| C28 | C27 | sing | 1.51Å | 1.54Å | |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.51Å | |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | O25 | sing | 1.34Å | 1.25Å | |
| C06 | O20 | doub | 1.21Å | 1.22Å | |
| C06 | N07 | sing | 1.35Å | 1.43Å | |
| O10 | C09 | doub | 1.21Å | 1.30Å | |
| N07 | C08 | sing | 1.46Å | 1.45Å | |
| C09 | O11 | sing | 1.34Å | 1.27Å | |
| C09 | C08 | sing | 1.51Å | 1.53Å | |
| O17 | C16 | sing | 1.36Å | 1.41Å | |
| C08 | C12 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | doub | 1.39Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.37Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C12 | sing | 1.51Å | 1.53Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| N07 | H071 | sing | 0.97Å | 1.00Å | |
| N21 | H1 | sing | 1.01Å | 1.00Å | |
| O11 | H2 | sing | 0.97Å | 0.95Å | |
| O17 | H171 | sing | 0.97Å | 0.95Å | |
| O25 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C33 | C32 | C31 | 118.3° | 120.0° |
| C32 | C33 | C28 | 120.5° | 120.0° |
| C33 | C32 | H321 | 120.9° | 120.0° |
| C32 | C33 | H331 | 119.7° | 120.0° |
| C32 | C31 | C30 | 121.1° | 120.0° |
| C32 | C31 | H311 | 119.5° | 120.0° |
| C31 | C32 | H321 | 120.8° | 120.0° |
| C03 | C04 | C05 | 113.4° | 109.5° |
| C04 | C03 | C02 | 112.7° | 109.4° |
| C04 | C03 | H031 | 108.7° | 109.4° |
| C04 | C03 | H032 | 108.6° | 109.5° |
| C03 | C04 | H042 | 108.5° | 109.5° |
| C03 | C04 | H041 | 108.5° | 109.5° |
| C04 | C05 | N21 | 107.6° | 109.5° |
| C04 | C05 | C06 | 111.7° | 109.5° |
| C05 | C04 | H042 | 108.4° | 109.5° |
| C05 | C04 | H041 | 108.4° | 109.4° |
| C04 | C05 | H051 | 108.9° | 109.5° |
| C33 | C28 | C27 | 121.8° | 120.0° |
| C33 | C28 | C29 | 120.8° | 120.0° |
| C28 | C33 | H331 | 119.7° | 120.0° |
| C31 | C30 | C29 | 120.3° | 120.0° |
| C31 | C30 | H301 | 119.8° | 120.1° |
| C30 | C31 | H311 | 119.4° | 120.0° |
| C03 | C02 | C01 | 113.7° | 109.5° |
| C03 | C02 | H021 | 108.4° | 109.5° |
| C03 | C02 | H022 | 108.4° | 109.5° |
| C02 | C03 | H031 | 108.6° | 109.5° |
| C02 | C03 | H032 | 108.7° | 109.5° |
| C05 | N21 | C22 | 111.0° | 111.0° |
| N21 | C05 | C06 | 110.0° | 109.4° |
| N21 | C05 | H051 | 109.6° | 109.5° |
| C05 | N21 | H1 | 109.1° | 111.0° |
| N21 | C22 | C26 | 110.3° | 109.4° |
| N21 | C22 | C23 | 107.9° | 109.5° |
| N21 | C22 | H221 | 110.7° | 109.5° |
| C22 | N21 | H1 | 109.1° | 111.0° |
| C22 | C26 | C27 | 111.4° | 109.4° |
| C26 | C22 | C23 | 108.4° | 109.4° |
| C26 | C22 | H221 | 109.7° | 109.5° |
| C22 | C26 | H262 | 109.0° | 109.5° |
| C22 | C26 | H261 | 109.0° | 109.5° |
| C26 | C27 | C28 | 113.7° | 109.4° |
| C27 | C26 | H262 | 109.0° | 109.5° |
| C27 | C26 | H261 | 109.0° | 109.5° |
| C26 | C27 | H272 | 108.4° | 109.5° |
| C26 | C27 | H271 | 108.4° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.4° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.4° | 109.5° |
| C01 | C02 | H022 | 108.4° | 109.4° |
| O24 | C23 | C22 | 120.3° | 120.0° |
| O24 | C23 | O25 | 124.8° | 120.0° |
| C05 | C06 | O20 | 125.4° | 120.0° |
| C05 | C06 | N07 | 117.9° | 120.0° |
| C06 | C05 | H051 | 109.0° | 109.5° |
| C27 | C28 | C29 | 117.4° | 120.0° |
| C28 | C27 | H272 | 108.4° | 109.5° |
| C28 | C27 | H271 | 108.4° | 109.5° |
| C28 | C29 | C30 | 118.9° | 120.0° |
| C28 | C29 | H291 | 120.5° | 120.0° |
| C22 | C23 | O25 | 114.9° | 120.0° |
| C23 | C22 | H221 | 109.8° | 109.5° |
| C30 | C29 | H291 | 120.6° | 120.0° |
| C29 | C30 | H301 | 119.8° | 120.0° |
| C23 | O25 | H3 | 109.5° | 117.0° |
| O20 | C06 | N07 | 116.6° | 120.0° |
| C06 | N07 | C08 | 119.5° | 120.0° |
| C06 | N07 | H071 | 120.2° | 120.0° |
| O10 | C09 | O11 | 121.2° | 120.0° |
| O10 | C09 | C08 | 120.4° | 120.0° |
| N07 | C08 | C09 | 108.7° | 109.4° |
| N07 | C08 | C12 | 114.4° | 109.5° |
| N07 | C08 | H081 | 109.2° | 109.5° |
| C08 | N07 | H071 | 120.3° | 120.0° |
| O11 | C09 | C08 | 118.3° | 120.0° |
| C09 | O11 | H2 | 109.5° | 116.9° |
| C09 | C08 | C12 | 108.1° | 109.5° |
| C09 | C08 | H081 | 108.2° | 109.5° |
| O17 | C16 | C15 | 119.2° | 120.0° |
| O17 | C16 | C18 | 119.6° | 120.1° |
| C16 | O17 | H171 | 109.5° | 114.0° |
| C08 | C12 | C13 | 116.1° | 109.5° |
| C08 | C12 | H122 | 107.8° | 109.5° |
| C08 | C12 | H121 | 107.8° | 109.4° |
| C12 | C08 | H081 | 108.1° | 109.5° |
| C16 | C15 | C14 | 119.0° | 120.0° |
| C15 | C16 | C18 | 121.2° | 119.9° |
| C16 | C15 | H151 | 120.5° | 120.0° |
| C15 | C14 | C13 | 119.6° | 120.1° |
| C15 | C14 | H141 | 120.2° | 120.0° |
| C14 | C15 | H151 | 120.5° | 120.0° |
| C16 | C18 | C19 | 119.6° | 120.0° |
| C16 | C18 | H181 | 120.2° | 120.0° |
| C14 | C13 | C19 | 121.5° | 120.1° |
| C14 | C13 | C12 | 120.5° | 120.0° |
| C13 | C14 | H141 | 120.2° | 119.9° |
| C18 | C19 | C13 | 119.2° | 120.0° |
| C19 | C18 | H181 | 120.2° | 120.0° |
| C18 | C19 | H191 | 120.4° | 120.0° |
| C19 | C13 | C12 | 118.0° | 119.9° |
| C13 | C19 | H191 | 120.4° | 120.0° |
| C13 | C12 | H122 | 107.8° | 109.5° |
| C13 | C12 | H121 | 107.8° | 109.5° |
| H122 | C12 | H121 | 109.5° | 109.5° |
| H262 | C26 | H261 | 109.5° | 109.5° |
| H011 | C01 | H013 | 109.4° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H013 | C01 | H012 | 109.4° | 109.5° |
| H021 | C02 | H022 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.5° |
| H042 | C04 | H041 | 109.5° | 109.5° |
| H272 | C27 | H271 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C33 | C32 | C31 | H321 | 180.0° | 179.4° |
| C32 | C33 | C28 | H331 | 180.0° | 179.5° |
| C33 | C32 | C31 | C30 | 0.3° | 0.3° |
| C32 | C33 | C28 | C27 | 179.0° | 179.7° |
| C32 | C33 | C28 | C29 | 0.7° | 0.6° |
| C33 | C32 | C31 | H311 | 179.7° | 179.7° |
| C31 | C32 | C33 | C28 | 0.3° | 0.6° |
| C32 | C31 | C30 | H311 | 180.0° | 180.0° |
| C32 | C31 | C30 | C29 | 0.5° | 0.0° |
| C32 | C31 | C30 | H301 | 179.5° | 179.9° |
| C31 | C32 | C33 | H331 | 179.7° | 180.0° |
| C03 | C04 | C05 | H042 | 120.6° | 120.0° |
| C03 | C04 | C05 | H041 | 120.6° | 120.0° |
| C04 | C03 | C02 | H031 | 120.5° | 119.9° |
| C04 | C03 | C02 | H032 | 120.5° | 120.0° |
| C03 | C04 | C05 | N21 | 176.7° | 63.9° |
| C04 | C03 | C02 | C01 | 170.0° | 180.0° |
| C03 | C04 | C05 | C06 | 62.5° | 176.1° |
| C04 | C03 | C02 | H021 | 69.4° | 60.0° |
| C04 | C03 | C02 | H022 | 49.4° | 60.0° |
| C04 | C03 | H031 | H032 | 118.5° | 120.0° |
| C03 | C04 | H042 | H041 | 118.2° | 120.0° |
| C03 | C04 | C05 | H051 | 58.1° | 56.1° |
| C05 | C04 | C03 | C02 | 64.7° | 175.0° |
| C04 | C05 | N21 | C06 | 121.9° | 120.0° |
| C04 | C05 | N21 | H051 | 118.3° | 120.0° |
| C04 | C05 | N21 | C22 | 172.8° | 154.2° |
| C04 | C05 | C06 | H051 | 120.4° | 120.0° |
| C04 | C05 | C06 | O20 | 88.3° | 120.0° |
| C04 | C05 | C06 | N07 | 89.3° | 60.0° |
| C05 | C04 | C03 | H031 | 174.8° | 65.0° |
| C05 | C04 | C03 | H032 | 55.8° | 55.0° |
| C05 | C04 | H042 | H041 | 118.2° | 120.0° |
| C04 | C05 | N21 | H1 | 67.0° | 81.8° |
| C33 | C28 | C27 | C26 | 14.8° | 90.2° |
| C33 | C28 | C27 | C29 | 179.7° | 179.7° |
| C33 | C28 | C29 | C30 | 0.5° | 0.3° |
| C33 | C28 | C27 | H272 | 135.4° | 149.8° |
| C33 | C28 | C27 | H271 | 105.9° | 29.7° |
| C33 | C28 | C29 | H291 | 179.5° | 179.8° |
| C28 | C33 | C32 | H321 | 179.7° | 180.0° |
| C31 | C30 | C29 | C28 | 0.1° | 0.0° |
| C31 | C30 | C29 | H301 | 180.0° | 180.0° |
| C31 | C30 | C29 | H291 | 179.9° | 179.9° |
| C30 | C31 | C32 | H321 | 179.7° | 179.7° |
| C03 | C02 | C01 | H021 | 120.6° | 120.1° |
| C03 | C02 | C01 | H022 | 120.6° | 120.0° |
| C03 | C02 | C01 | H011 | 180.0° | 60.0° |
| C03 | C02 | C01 | H013 | 60.0° | 60.0° |
| C03 | C02 | C01 | H012 | 60.0° | 180.0° |
| C03 | C02 | H021 | H022 | 118.1° | 120.0° |
| C02 | C03 | H031 | H032 | 118.5° | 120.1° |
| C02 | C03 | C04 | H042 | 174.7° | 55.0° |
| C02 | C03 | C04 | H041 | 55.9° | 65.1° |
| C05 | N21 | C22 | H1 | 120.2° | 123.9° |
| C05 | N21 | C22 | C26 | 179.7° | 155.7° |
| N21 | C05 | C06 | H051 | 120.2° | 120.0° |
| C05 | N21 | C22 | C23 | 62.1° | 84.4° |
| N21 | C05 | C06 | O20 | 31.1° | 0.0° |
| N21 | C05 | C06 | N07 | 151.4° | 180.0° |
| C05 | N21 | C22 | H221 | 58.1° | 35.6° |
| N21 | C05 | C04 | H042 | 62.7° | 176.1° |
| N21 | C05 | C04 | H041 | 56.1° | 56.1° |
| N21 | C22 | C26 | C23 | 117.9° | 120.0° |
| N21 | C22 | C26 | H221 | 122.2° | 120.0° |
| N21 | C22 | C26 | C27 | 167.6° | 65.0° |
| N21 | C22 | C23 | O24 | 47.1° | 27.0° |
| C22 | N21 | C05 | C06 | 65.4° | 85.7° |
| N21 | C22 | C23 | H221 | 120.8° | 120.1° |
| N21 | C22 | C23 | O25 | 130.5° | 152.9° |
| N21 | C22 | C26 | H262 | 47.4° | 54.9° |
| N21 | C22 | C26 | H261 | 72.1° | 175.0° |
| C22 | N21 | C05 | H051 | 54.5° | 34.2° |
| C22 | C26 | C27 | H262 | 120.3° | 120.0° |
| C22 | C26 | C27 | H261 | 120.3° | 119.9° |
| C26 | C22 | C23 | O24 | 72.4° | 92.9° |
| C22 | C26 | C27 | C28 | 174.1° | 180.0° |
| C26 | C22 | C23 | H221 | 119.8° | 120.0° |
| C26 | C22 | C23 | O25 | 110.0° | 87.2° |
| C22 | C26 | H262 | H261 | 119.1° | 120.0° |
| C22 | C26 | C27 | H272 | 65.3° | 60.0° |
| C22 | C26 | C27 | H271 | 53.5° | 60.1° |
| C26 | C22 | N21 | H1 | 59.5° | 31.7° |
| C26 | C27 | C28 | H272 | 120.6° | 120.0° |
| C26 | C27 | C28 | H271 | 120.6° | 120.0° |
| C26 | C27 | C28 | C29 | 165.0° | 90.0° |
| C27 | C26 | C22 | C23 | 74.5° | 175.0° |
| C27 | C26 | C22 | H221 | 45.4° | 55.0° |
| C27 | C26 | H262 | H261 | 119.1° | 120.0° |
| C26 | C27 | H272 | H271 | 118.1° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H013 | H012 | 120.0° | 120.0° |
| C01 | C02 | H021 | H022 | 118.1° | 119.9° |
| C01 | C02 | C03 | H031 | 49.5° | 60.0° |
| C01 | C02 | C03 | H032 | 69.5° | 60.1° |
| O24 | C23 | C22 | O25 | 177.6° | 179.9° |
| O24 | C23 | C22 | H221 | 167.8° | 147.1° |
| O24 | C23 | O25 | H3 | 0.0° | 0.1° |
| C05 | C06 | O20 | N07 | 177.5° | 180.0° |
| C05 | C06 | N07 | C08 | 177.0° | 180.0° |
| C06 | C05 | C04 | H042 | 58.1° | 56.1° |
| C06 | C05 | C04 | H041 | 176.9° | 63.9° |
| C05 | C06 | N07 | H071 | 3.0° | 0.0° |
| C06 | C05 | N21 | H1 | 54.9° | 38.2° |
| C27 | C28 | C29 | C30 | 179.2° | 180.0° |
| C28 | C27 | C26 | H262 | 53.8° | 60.0° |
| C28 | C27 | C26 | H261 | 65.6° | 60.0° |
| C28 | C27 | H272 | H271 | 118.1° | 120.0° |
| C27 | C28 | C29 | H291 | 0.8° | 0.1° |
| C27 | C28 | C33 | H331 | 1.0° | 0.2° |
| C28 | C29 | C30 | H291 | 180.0° | 179.9° |
| C29 | C28 | C27 | H272 | 44.4° | 29.9° |
| C29 | C28 | C27 | H271 | 74.4° | 150.0° |
| C28 | C29 | C30 | H301 | 179.9° | 179.9° |
| C29 | C28 | C33 | H331 | 179.3° | 179.9° |
| C23 | C22 | C26 | H262 | 165.3° | 65.0° |
| C23 | C22 | C26 | H261 | 45.8° | 55.0° |
| C23 | C22 | N21 | H1 | 177.7° | 151.6° |
| C22 | C23 | O25 | H3 | 177.5° | 179.9° |
| C29 | C30 | C31 | H311 | 179.6° | 180.0° |
| O25 | C23 | C22 | H221 | 9.7° | 32.8° |
| O20 | C06 | N07 | C08 | 0.8° | 0.0° |
| O20 | C06 | C05 | H051 | 151.3° | 120.0° |
| O20 | C06 | N07 | H071 | 179.2° | 180.0° |
| C06 | N07 | C08 | H071 | 180.0° | 180.0° |
| C06 | N07 | C08 | C09 | 64.2° | 85.0° |
| C06 | N07 | C08 | C12 | 174.9° | 155.0° |
| N07 | C06 | C05 | H051 | 31.2° | 60.0° |
| C06 | N07 | C08 | H081 | 53.6° | 35.0° |
| O10 | C09 | C08 | N07 | 24.1° | 0.0° |
| O10 | C09 | O11 | C08 | 178.6° | 179.9° |
| O10 | C09 | C08 | C12 | 100.6° | 120.0° |
| O10 | C09 | C08 | H081 | 142.5° | 120.0° |
| O10 | C09 | O11 | H2 | 0.0° | 0.1° |
| N07 | C08 | C09 | O11 | 154.6° | 180.0° |
| N07 | C08 | C09 | C12 | 124.7° | 120.0° |
| N07 | C08 | C09 | H081 | 118.4° | 120.0° |
| N07 | C08 | C12 | H081 | 121.9° | 120.0° |
| N07 | C08 | C12 | C13 | 31.8° | 65.0° |
| N07 | C08 | C12 | H122 | 152.7° | 175.0° |
| N07 | C08 | C12 | H121 | 89.2° | 55.0° |
| O11 | C09 | C08 | C12 | 80.7° | 60.0° |
| O11 | C09 | C08 | H081 | 36.1° | 60.1° |
| C09 | C08 | C12 | H081 | 116.9° | 120.0° |
| C09 | C08 | C12 | C13 | 89.5° | 175.0° |
| C09 | C08 | C12 | H122 | 31.4° | 55.0° |
| C09 | C08 | C12 | H121 | 149.5° | 65.0° |
| C09 | C08 | N07 | H071 | 115.8° | 95.0° |
| C08 | C09 | O11 | H2 | 178.6° | 180.0° |
| O17 | C16 | C15 | C18 | 179.3° | 179.9° |
| O17 | C16 | C15 | C14 | 178.9° | 180.0° |
| O17 | C16 | C18 | C19 | 179.9° | 179.8° |
| O17 | C16 | C15 | H151 | 1.1° | 0.1° |
| O17 | C16 | C18 | H181 | 0.1° | 0.1° |
| C08 | C12 | C13 | C14 | 93.5° | 90.0° |
| C08 | C12 | C13 | C19 | 88.1° | 90.0° |
| C08 | C12 | C13 | H122 | 120.9° | 120.0° |
| C08 | C12 | C13 | H121 | 121.0° | 120.0° |
| C08 | C12 | H122 | H121 | 117.0° | 120.0° |
| C12 | C08 | N07 | H071 | 5.1° | 25.0° |
| C16 | C15 | C14 | H151 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 1.1° | 0.0° |
| C15 | C16 | C18 | C19 | 0.8° | 0.3° |
| C16 | C15 | C14 | H141 | 178.9° | 179.7° |
| C15 | C16 | C18 | H181 | 179.2° | 180.0° |
| C15 | C16 | O17 | H171 | 180.0° | 90.0° |
| C14 | C15 | C16 | C18 | 0.3° | 0.1° |
| C15 | C14 | C13 | H141 | 180.0° | 179.7° |
| C15 | C14 | C13 | C19 | 0.7° | 0.2° |
| C15 | C14 | C13 | C12 | 179.0° | 179.7° |
| C16 | C18 | C19 | H181 | 180.0° | 179.7° |
| C16 | C18 | C19 | C13 | 1.2° | 0.5° |
| C18 | C16 | C15 | H151 | 179.6° | 180.0° |
| C16 | C18 | C19 | H191 | 178.8° | 179.9° |
| C18 | C16 | O17 | H171 | 0.7° | 90.1° |
| C14 | C13 | C19 | C18 | 0.5° | 0.5° |
| C14 | C13 | C19 | C12 | 178.4° | 180.0° |
| C14 | C13 | C12 | H122 | 27.4° | 150.0° |
| C14 | C13 | C12 | H121 | 145.5° | 30.0° |
| C13 | C14 | C15 | H151 | 178.9° | 180.0° |
| C14 | C13 | C19 | H191 | 179.5° | 180.0° |
| C18 | C19 | C13 | H191 | 180.0° | 179.6° |
| C18 | C19 | C13 | C12 | 177.9° | 179.5° |
| C19 | C13 | C14 | H141 | 179.3° | 179.9° |
| C19 | C13 | C12 | H122 | 151.0° | 30.1° |
| C19 | C13 | C12 | H121 | 32.9° | 150.1° |
| C13 | C19 | C18 | H181 | 178.8° | 179.8° |
| C12 | C13 | C14 | H141 | 0.9° | 0.0° |
| C13 | C12 | H122 | H121 | 117.0° | 120.0° |
| C12 | C13 | C19 | H191 | 2.1° | 0.1° |
| C13 | C12 | C08 | H081 | 153.6° | 55.0° |
| H141 | C14 | C15 | H151 | 1.1° | 0.3° |
| H122 | C12 | C08 | H081 | 85.4° | 65.0° |
| H121 | C12 | C08 | H081 | 32.7° | 175.0° |
| H181 | C18 | C19 | H191 | 1.3° | 0.2° |
| H221 | C22 | C26 | H262 | 74.9° | 175.0° |
| H221 | C22 | C26 | H261 | 165.7° | 64.9° |
| H221 | C22 | N21 | H1 | 62.1° | 88.3° |
| H262 | C26 | C27 | H272 | 174.5° | 180.0° |
| H262 | C26 | C27 | H271 | 66.8° | 60.0° |
| H261 | C26 | C27 | H272 | 55.0° | 60.0° |
| H261 | C26 | C27 | H271 | 173.7° | NaN° |
| H011 | C01 | H013 | H012 | 120.0° | 120.0° |
| H011 | C01 | C02 | H021 | 59.4° | 60.0° |
| H011 | C01 | C02 | H022 | 59.4° | 180.0° |
| H013 | C01 | C02 | H021 | 179.4° | 180.0° |
| H013 | C01 | C02 | H022 | 60.6° | 60.0° |
| H012 | C01 | C02 | H021 | 60.6° | 59.9° |
| H012 | C01 | C02 | H022 | 179.4° | 60.0° |
| H021 | C02 | C03 | H031 | 170.2° | 180.0° |
| H021 | C02 | C03 | H032 | 51.1° | 60.0° |
| H022 | C02 | C03 | H031 | 71.1° | 59.9° |
| H022 | C02 | C03 | H032 | 169.9° | 180.0° |
| H031 | C03 | C04 | H042 | 54.3° | 175.0° |
| H031 | C03 | C04 | H041 | 64.6° | 54.9° |
| H032 | C03 | C04 | H042 | 64.8° | 65.0° |
| H032 | C03 | C04 | H041 | 176.4° | 175.0° |
| H042 | C04 | C05 | H051 | 178.6° | 63.9° |
| H041 | C04 | C05 | H051 | 62.5° | 176.1° |
| H051 | C05 | N21 | H1 | 174.8° | 158.2° |
| H081 | C08 | N07 | H071 | 126.4° | 145.0° |
| H291 | C29 | C30 | H301 | 0.1° | 0.0° |
| H301 | C30 | C31 | H311 | 0.5° | 0.0° |
| H311 | C31 | C32 | H321 | 0.3° | 0.3° |
| H321 | C32 | C33 | H331 | 0.3° | 0.5° |
